SCHEMBL8943824

SCHEMBL8943824

Cc1cccc(N(c2ccccc2)c2ccc(Oc3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 2/20 0.50
HSD17B2 P37059 2/20 0.50
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 3/20 0.42
MAPK1 P28482 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
MAPT P10636 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
HTR2B P41595 1/20 0.42
CYP51A1 Q16850 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
LTA4H P09960 4/20 0.40
GFER P55789 1/20 0.40

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
SCHEMBL8943708 0.96 HSD17B1 (0.53) HSD17B1HSD17B2ALDH1A1TDP1MAPK1
SCHEMBL13030516 0.93 HSD17B1 (0.57) HSD17B1HSD17B2ALDH1A1TDP1MAPK1
SCHEMBL8944074 0.90 ACHE (0.48) HSD17B1HSD17B2ALDH1A1TDP1L3MBTL1
SCHEMBL13886460 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL13844494 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL13720602 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL10065627 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL22812841 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL10065551 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4
SCHEMBL13017732 0.89 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed