SCHEMBL503877

SCHEMBL503877

COc1ccc(C2(C(=O)O)CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.63
MEN1 O00255 1/20 0.63
TSHR P16473 1/20 0.63
TET3 O43151 1/20 0.59
FBXL19 Q6PCT2 1/20 0.59
CXXC5 Q7LFL8 1/20 0.59
TET1 Q8NFU7 1/20 0.59
KDM2B Q8NHM5 1/20 0.59
CXXC4 Q9H2H0 1/20 0.59
KDM2A Q9Y2K7 1/20 0.59
AKR1C1 Q04828 1/20 0.59
CYP3A4 P08684 1/20 0.57
CYP2C19 P33261 1/20 0.57
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 2/20 0.55
MAPT P10636 2/20 0.55
MAPK1 P28482 1/20 0.55
GAA P10253 1/20 0.51
HPGD P15428 2/20 0.50
LMNA P02545 2/20 0.49

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
SCHEMBL21874269 1.00 KMT2A (0.63) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL503291 0.98 KMT2A (0.65) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL3443266 0.95 KMT2A (0.61) KMT2AMEN1TSHRTET3FBXL19
Formic Acid SCHEMBL27562726 0.92 KMT2A (0.59) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL301027 0.91 KMT2A (0.64) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL15256583 0.86 CYP3A4 (0.57) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL8589035 0.86 KMT2A (0.52) KMT2AMEN1TSHRTET3FBXL19
SCHEMBL2112323 0.85 LMNA (0.68) KMT2AMEN1TSHRCYP3A4CYP2C19
SCHEMBL4807202 0.85 CYP3A4 (0.56) KMT2AMEN1TSHRCYP3A4CYP2C19
SCHEMBL8587646 0.85 KDM4E (0.57) KMT2AMEN1TSHRCYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663029-A DEVELOPMENT OF LATENT IMAGE, TRANSFERRING TO FORM RECORDING SHEETS, COATING A SUBSTRATE USING POLYMERS XEROX CORPORATION (US) 1997-09-02 US claimed
US-RE50453-E1 Indole derivatives as CFTR modulators VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-06-10 US disclosed
US-20240092766-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2024-03-21 US disclosed
US-11639347-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-05-02 US disclosed
US-11639347-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-05-02 US disclosed
US-11639347-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-05-02 US disclosed
US-20230127655-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-04-27 US disclosed
US-20230127655-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-04-27 US disclosed
US-20230127655-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-04-27 US disclosed
US-20230100634-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-03-30 US disclosed
EP-0233267-A1 SMECTIC CRYSTAL PHASES. MERCK PATENT GMBH (DE) 1987-08-26 EP disclosed
EP-0120712-B1 POLISH COMPOSITIONS AND POLISH VEHICLES USEFUL THEREIN ROHM AND HAAS COMPANY (US) 1987-06-24 EP disclosed
WO-1987001717-A2 SMECTIC CYSTAL PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-03-26 WO disclosed
EP-0180319-A1 Washout resistant coating or caulking compositions and applications thereof ROHM AND HAAS COMPANY (US) 1986-05-07 EP disclosed
US-4571415-A Washout resistant coatings ROHM AND HAAS COMPANY (US) 1986-02-18 US disclosed
US-4517330-A ACID COPOLYMER CROSSLINKING WITH TRANSITION METAL ROHM AND HAAS COMPANY (US) 1985-05-14 US disclosed
EP-0122788-A2 Self-leveling polish compositions and polymer compositions useful therein ROHM AND HAAS COMPANY (US) 1984-10-24 EP disclosed
EP-0120712-A2 Polish compositions and polish vehicles useful therein ROHM AND HAAS COMPANY (US) 1984-10-03 EP disclosed
US-4460734-A ETHYLENE OXIDE FATTY ALCOHOL ADDUCT, ADDITION POLYMER ROHM AND HAAS COMPANY (US) 1984-07-17 US disclosed
US-4247597-A Electroscopic carrier particles having a carboxylic acid surface treatment PITNEY BOWES, INC. (US) 1981-01-27 US 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 (4 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-20240092766-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KMT2A 4313/4885MEN1 4687/4885TSHR 2748/4885
US-11639347-B2 Modulators of ATP-binding cassette transporters CFTR, ABCB1, ABCC2 KMT2A 4313/4885MEN1 4687/4885TSHR 2748/4885
US-20230100634-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KMT2A 4313/4885MEN1 4687/4885TSHR 2748/4885
US-20230127655-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 KMT2A 4313/4885MEN1 4687/4885TSHR 2748/4885

“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.