SCHEMBL9338020

SCHEMBL9338020

CCCCCCCCCCCCCCCCCCSc1ccc(C(=O)/C=C/c2ccc(Br)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.55
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ MAOB P27338 2/20 0.55
▸ POLB P06746 2/20 0.55
▸ USP2 O75604 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ TLR9 Q9NR96 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ ESR1 P03372 1/20 0.53
▸ ESR2 Q92731 1/20 0.53
▸ MAOA P21397 1/20 0.52
▸ CYP1B1 Q16678 1/20 0.51
▸ ABCG2 Q9UNQ0 2/20 0.51
▸ THRA P10827 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ LMNA P02545 4/20 0.47

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
SCHEMBL9337929 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL10498452 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL10497537 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL10497524 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL9337937 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL9338046 1.00 MAPT (0.55) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL9342012 0.95 MAPT (0.57) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL9342016 0.95 MAPT (0.57) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL10497832 0.89 ABCG2 (0.65) MAPTKMT2AMEN1ALDH1A1MAOB
SCHEMBL10497584 0.89 ABCG2 (0.52) MAPTKMT2AMEN1ALDH1A1POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP claimed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP claimed
EP-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 — — EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 — — US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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