SCHEMBL7128153

SCHEMBL7128153

COc1cc2ccccc2c2c1OC(c1ccccc1)(c1ccccc1)C=C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.40
GPR84 Q9NQS5 4/20 0.38
NQO1 P15559 1/20 0.35
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
BRCA1 P38398 1/20 0.34
HNF4A P41235 1/20 0.34
HIF1A Q16665 1/20 0.34
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33
KDM4E B2RXH2 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KRAS P01116 1/20 0.33
SOS1 Q07889 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL7132115 0.90 PDE4D (0.40) PDE4DNQO1HPGDSMN1; SMN2LMNA
SCHEMBL7132099 0.88 KDM4E (0.39) PDE4DHPGDSMN1; SMN2LMNACYP1A2
SCHEMBL7888138 0.84 HTT (0.36) GPR84HPGDSMN1; SMN2LMNAALDH1A1
SCHEMBL8680951 0.83 PDE4D (0.43) PDE4DGPR84NQO1HPGDSMN1; SMN2
SCHEMBL8782497 0.83 TSHR (0.36) GPR84HPGDSMN1; SMN2HIF1AALDH1A1
SCHEMBL8782636 0.83 GPR84 (0.39) GPR84HPGDSMN1; SMN2ALDH1A1MAPT
SCHEMBL21938197 0.82 GPR84 (0.41) GPR84HPGDSMN1; SMN2LMNACYP1A2
SCHEMBL8782919 0.81 ALDH1A1 (0.45) GPR84HPGDLMNAALDH1A1KDM4E
SCHEMBL8782625 0.81 ADORA3 (0.38) HPGDALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL8782713 0.81 ESR1 (0.39) GPR84MAPTL3MBTL1CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628064-B2 PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 2003-12-10 EP disclosed
EP-0628064-B1 PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL INC (US) 1999-04-07 EP disclosed
US-5585042-A REVERSIBLE CHANGE IN COLOR WHEN EXPOSURED TO ULTRAVIOLET RADIATION TRANSITIONS OPTICAL, INC. (US) 1996-12-17 US disclosed
EP-0628064-A4 PHOTOCHROMIC NAPHTHOPYRANS. PPG INDUSTRIES INC (US) 1995-02-08 EP disclosed
EP-0628064-A1 PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 1994-12-14 EP disclosed
US-5369158-A And polymer TRANSITIONS OPTICAL, INC. (US) 1994-11-29 US disclosed
WO-1993017071-A1 PHOTOCHROMIC NAPHTHOPYRANS PPG INDUSTRIES, INC. (US) 1993-09-02 WO disclosed
US-5238981-A PHOTOCHROMIC NAPHTHOPYRANS TRANSITIONS OPTICAL, INC. (US) 1993-08-24 US disclosed