SCHEMBL4459580

SCHEMBL4459580

O=C(Nc1cccc(OC(F)(F)F)c1)Oc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
ALDH1A1 P00352 5/20 0.55
MAPT P10636 3/20 0.55
GAA P10253 2/20 0.55
HTT P42858 2/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
EPHX2 P34913 1/20 0.55
KMT2A Q03164 1/20 0.55
P2RX1 P51575 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
FAAH O00519 1/20 0.52
CYP3A4 P08684 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27682718 0.91 KMT2A (0.62) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL2515018 0.87 EPHX2 (0.58) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL4351772 0.85 EPHX2 (0.63) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL2094767 0.85 NPC1 (0.63) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL23240195 0.85 ALDH1A1 (0.48) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL29716280 0.85 ALDH1A1 (0.48) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL2095975 0.84 ALDH1A1 (0.60) ALDH1A1MAPTGAAHTTHPGD
SCHEMBL8048626 0.84 CYP1A2 (0.76) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL29739464 0.84 CYP1A2 (0.62) CYP1A2ALDH1A1MAPTGAAHTT
SCHEMBL2094765 0.84 ALDH1A1 (0.56) ALDH1A1MAPTGAAHTTHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662206-A1 GSPT1 DEGRADER COMPOUNDS Captor Therapeutics S.A. (PL) 2025-12-17 EP disclosed
US-12391663-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS AG (CH) 2025-08-19 US disclosed
US-20240308976-A1 COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND USES THEREOF MONTE ROSA THERAPEUTICS AG (CH) 2024-09-19 US disclosed
WO-2024165577-A1 GSPT1 DEGRADER COMPOUNDS CAPTOR THERAPEUTICS S.A. (PL) 2024-08-15 WO disclosed
WO-2024167423-A1 GSPT1 DEGRADER COMPOUNDS CAPTOR THERAPEUTICS S.A. (PL) 2024-08-15 WO disclosed
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MONTE ROSA THERAPEUTICS AG (CH) 2024-08-08 US disclosed
US-20240216355-A1 PHARMACEUTICAL COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF A DISEASE OR DISORDER CAUSED BY OR ASSOCIATED WITH ONE OR MORE PREMATURE TERMINATION CODONS MONTE ROSA THERAPEUTICS AG (CH) 2024-07-04 US disclosed
US-20240083869-A1 ISOINDOLINONE COMPOUNDS MONTE ROSA THERAPEUTICS AG (CH) 2024-03-14 US disclosed
US-11912682-B2 Isoindolinone compounds MONTE ROSA THERAPEUTICS, INC. (US) 2024-02-27 US disclosed
EP-4323350-A1 ISOINDOLINONE COMPOUNDS Monte Rosa Therapeutics AG (CH) 2024-02-21 EP disclosed
CN-1993361-A Pyrrolotriazine derivatives useful for treating hyper-proliferative disorders and diseases associated with angiogenesis BAYER PHARMACEUTICALS CORP (US) 2007-07-04 CN disclosed
WO-2006043090-A1 IMIDAZO[4,5-B]PYRIDIN-2-ONE AND OXAZOLO[4,5-B]PYRIDIN-2-ONE COMPOUNDS AND ANALOGS THEREOF AS THERAPEUTIC COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-04-27 WO disclosed
US-20050250816-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor PFIZER INC 2005-11-10 US disclosed
US-20050154230-A1 Urea derivatives BAYER HEALTHCARE AG (DE) 2005-07-14 US disclosed
US-20040254373-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor PFIZER INC 2004-12-16 US disclosed
US-20040249150-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor PFIZER INC 2004-12-09 US disclosed
EP-1461311-A2 UREA DERIVATIVES AS VR1-ANTAGONISTS Bayer HealthCare AG (DE) 2004-09-29 EP disclosed
US-20030236287-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor PHARMACIA & UPJOHN COMPANY 2003-12-25 US disclosed
WO-2003093250-A2 POSITIVE ALLOSTERIC MODULATORS OF THE NICOTINIC ACETYLCHOLINE RECEPTOR PHARMACIA & UPJOHN COMPANY (US) 2003-11-13 WO disclosed
WO-2003055848-A2 UREA DERIVATIVES AS VR1- ANTAGONISTS BAYER HEALTHCARE AG (DE) 2003-07-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040254373-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor CHRNA1, CHRNB1, CHRM1 CYP1A2 1827/4885ALDH1A1 2007/4885MAPT 1550/4885
US-20030236287-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor CHRNA1, CHRNB1, CHRM1 CYP1A2 1827/4885ALDH1A1 2007/4885MAPT 1550/4885
US-12391663-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 CYP1A2 146/4885ALDH1A1 1142/4885MAPT 4795/4885
US-20240083869-A1 ISOINDOLINONE COMPOUNDS CYP4F2, AOC2, AOC3 CYP1A2 146/4885ALDH1A1 1142/4885MAPT 4795/4885
US-20050154230-A1 Urea derivatives SLC14A1, UBA1, VAT1 CYP1A2 3223/4885ALDH1A1 218/4885MAPT 2294/4885
US-20240216355-A1 PHARMACEUTICAL COMPOSITIONS FOR USE IN THE PREVENTION AND TREATMENT OF A DISEASE OR DISORDER CAUSED BY OR ASSOCIATED WITH ONE OR MORE PREMATURE TERMINATION CODONS UPF1, NSUN2, RTF2 CYP1A2 1677/4885ALDH1A1 4150/4885MAPT 4671/4885
US-20240308976-A1 COMPOUNDS THAT MEDIATE PROTEIN DEGRADATION AND USES THEREOF CRBN, GSPT1, GSPT2 CYP1A2 4774/4885ALDH1A1 4088/4885MAPT 3269/4885
US-11912682-B2 Isoindolinone compounds CYP4F2, AOC2, AOC3 CYP1A2 146/4885ALDH1A1 1142/4885MAPT 4795/4885
US-20040249150-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor CHRNA1, CHRNB1, CHRM1 CYP1A2 1827/4885ALDH1A1 2007/4885MAPT 1550/4885
US-20240261274-A1 TREATMENT OF MYC-DRIVEN CANCERS WITH GSPT1 DEGRADERS MYC, MYCBP, GSPT1 CYP1A2 4692/4885ALDH1A1 4276/4885MAPT 3196/4885
US-20050250816-A1 Positive allosteric modulators of the nicotinic acetylcholine receptor CHRNA7, CHRNA1, CHRNA5 CYP1A2 1913/4885ALDH1A1 2742/4885MAPT 1395/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.