SCHEMBL11345015

SCHEMBL11345015

C=Cc1ccc(C(OC(c2ccc(C=C)cc2)c2ccc(Nc3ccccc3)cc2)c2ccc(Nc3ccccc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.43
HSD17B10 Q99714 6/20 0.43
TSHR P16473 5/20 0.43
ALOX12 P18054 5/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
ALOX15 P16050 3/20 0.43
MAPK1 P28482 3/20 0.43
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43
PTGS2 P35354 1/20 0.43
HTR2B P41595 1/20 0.43
CYP3A4 P08684 5/20 0.38
LMNA P02545 3/20 0.38
THRB P10828 2/20 0.38
RECQL P46063 1/20 0.38
ATM Q13315 1/20 0.38
MAPT P10636 3/20 0.37
HPGD P15428 3/20 0.37
HTT P42858 2/20 0.37

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
SCHEMBL11337446 0.85 HPGD (0.40) ALDH1A1L3MBTL1TDP1MAPK1CYP3A4
SCHEMBL290949 0.84 ALDH1A1 (0.62) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
Benzene SCHEMBL7583977 0.80 ALDH1A1 (0.58) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
SCHEMBL17283641 0.78 ALDH1A1 (0.54) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
Diphenylamine SCHEMBL2427538 0.78 ALDH1A1 (0.70) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
SCHEMBL11563830 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
SCHEMBL1697678 0.75 ALDH1A1 (0.65) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
SCHEMBL15591054 0.74 ALDH1A1 (0.52) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
SCHEMBL15515041 0.74 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRALOX12L3MBTL1
Diphenylamine SCHEMBL20657024 0.73 HPGD (0.65) ALDH1A1HSD17B10TSHRALOX12L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4298522-A HEAT AND AGING RESISTANCE NIPPON ZEON CO. LTD. (JP) 1981-11-03 US claimed
US-4298522-A HEAT AND AGING RESISTANCE NIPPON ZEON CO. LTD. (JP) 1981-11-03 US disclosed