SCHEMBL160761

SCHEMBL160761

COc1[c]ccc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 2/20 0.34
MAPK1 P28482 2/20 0.34
CFTR P13569 1/20 0.34
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NQO2 P16083 1/20 0.34
PDE2A O00408 2/20 0.33
KIF11 P52732 1/20 0.33
ACHE P22303 1/20 0.33
TSHR P16473 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAT2A P31153 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL954706 0.82 ALDH1A1 (0.34) MAPTKIF11TSHRSMN1; SMN2ALDH1A1
SCHEMBL9004920 0.81 KDM4E (0.43) NPSR1KIF11SMN1; SMN2KDM4EALDH1A1
SCHEMBL5547736 0.80 SMN1; SMN2 (0.33) L3MBTL1MAPTCFTRLMNAPDE2A
SCHEMBL5054248 0.80 TSHR (0.34) TSHR
SCHEMBL1068587 0.80 CES2 (0.32) L3MBTL1MAPTMAPK1CFTRPDE2A
SCHEMBL6226618 0.79 L3MBTL1 (0.41) L3MBTL1MAPTMAPK1LMNANPSR1
SCHEMBL15352508 0.79 PDE2A (0.38) MAPTLMNANPSR1PDE2AKIF11
SCHEMBL8135398 0.78 CYP11B1 (0.31)
SCHEMBL160634 0.77 MAPT (0.36) L3MBTL1MAPTMAPK1PDE2ATSHR
SCHEMBL1066344 0.77 MEN1 (0.35) MAPTMAPK1LMNANPSR1PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932609-B1 Substituted 1,4-dihydropyrimidines as antitubercular agents King Faisal University (SA) 2024-03-19 US claimed
US-11712438-B2 Phenyl derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2023-08-01 US claimed
EP-3625222-B1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2021-07-21 EP claimed
US-10772874-B2 Compounds and compositions for the inhibition of NAMPT VALO HEALTH, INC. 2020-09-15 US claimed
EP-3348547-B1 BENZIMIDAZOLE DERIVATIVES AS NAV 1.7 (SODIUM CHANNEL, VOLTAGE-GATED, TYPE IX, ALPHA SUBUNIT (SCN9A)) INHIBITORS FOR TREATING PAIN, DYSURIA AND MULTIPLE SCLEROSIS SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2020-07-22 EP claimed
US-20200179383-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS ACTELION PHARMACEUTICALS LTD (CH) 2020-06-11 US claimed
EP-3625222-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS Idorsia Pharmaceuticals Ltd (CH) 2020-03-25 EP claimed
CN-110612296-A Phenyl derivatives as PGE2 receptor modulators 爱杜西亚药品有限公司 2019-12-24 CN claimed
US-10272072-B2 Compounds and compositions for the inhibition of NAMPT FORMA TM, LLC (US) 2019-04-30 US claimed
WO-2018210994-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2018-11-22 WO claimed
US-20040043987-A1 Novel compounds and their use as positive AMPA receptor modulators NEUROSEARCH A/S. 2004-03-04 US claimed
EP-1383747-A1 FUSED PYRIMIDINES AS ANTAGONISTS OF THE CORTICOTROPIN RELEASING FACTOR (CRF) GLAXO GROUP LIMITED (GB) 2004-01-28 EP claimed
EP-1383498-A1 CRF RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2004-01-28 EP claimed
WO-2003008412-A2 HETERO-BICYCLIC CRF ANTAGONISTS GLAXO GROUP LIMITED (GB) 2003-01-30 WO claimed
WO-2003008414-A1 CHEMICAL COMPOUNDS SB PHARMCO PUERTO RICO INC. (PR) 2003-01-30 WO claimed
WO-2002100863-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2002-12-19 WO claimed
WO-2002087573-A1 CRF RECEPTOR ANTAGONISTS GLAXO GROUP LIMITED (GB) 2002-11-07 WO claimed
WO-2002088095-A1 FUSED PYRIMIDINES AS ANTAGONISTS OF THE CORTICOTROPIN RELEASING FACTOR (CRF) GLAXO GROUP LIMITED (GB) 2002-11-07 WO claimed
EP-1071426-A2 NOVEL COMPOUNDS AND THEIR USE AS POSITIVE AMPA RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2001-01-31 EP claimed
WO-1999042456-A2 NOVEL COMPOUNDS AND THEIR USE AS POSITIVE AMPA RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 1999-08-26 WO claimed

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

For each of this compound's patents that has machine-readable text (6 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-11712438-B2 Phenyl derivatives as PGE2 receptor modulators PTGER1, PTGER4, PTGER2 L3MBTL1 4109/4885RAB9A 4075/4885MAPT 4435/4885
US-20200179383-A1 PHENYL DERIVATIVES AS PGE2 RECEPTOR MODULATORS PTGER1, PTGER4, PTGER2 L3MBTL1 4017/4885RAB9A 4040/4885MAPT 4397/4885
US-10772874-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NQO1 L3MBTL1 2990/4885RAB9A 1917/4885MAPT 268/4885
US-20040043987-A1 Novel compounds and their use as positive AMPA receptor modulators GRIK4, GRIA4, GRM2 L3MBTL1 2411/4885RAB9A 3042/4885MAPT 4215/4885
US-10272072-B2 Compounds and compositions for the inhibition of NAMPT NAMPT, NNMT, NQO1 L3MBTL1 2990/4885RAB9A 1917/4885MAPT 268/4885
US-11932609-B1 Substituted 1,4-dihydropyrimidines as antitubercular agents DPYD, DUT, TYMP L3MBTL1 1587/4885RAB9A 2769/4885MAPT 1719/4885

“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.