SCHEMBL8798158

SCHEMBL8798158

O=C(Nc1ccc(F)cc1F)C1c2ccccc2COc2ccc(Br)cc21

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 5/20 0.42
RAB9A P51151 5/20 0.42
MAPK14 Q16539 1/20 0.41
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 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
SCHEMBL8620512 0.82 RAB9A (0.41) KMT2ATAS1R3TAS1R1TAS1R2POLB
SCHEMBL8797523 0.78 MAPT (0.41) KMT2AALDH1A1NPC1RAB9AMAPT
SCHEMBL8797482 0.77 LPAR1 (0.45) KMT2APOLBALDH1A1RAB9AMAPT
SCHEMBL8797675 0.76 HTT (0.43) MAPTHTT
SCHEMBL6938853 0.76 TBXA2R (0.45)
SCHEMBL8797024 0.75 GRM7 (0.41) KMT2AMAPTMEN1HTTSMN1; SMN2
SCHEMBL8797251 0.74 NOTUM (0.43) ALDH1A1
SCHEMBL8797028 0.72 TBXA2R (0.38) KMT2APOLBALDH1A1RAB9AMAPT
SCHEMBL9329609 0.72 TBXA2R (0.38) KMT2APOLBALDH1A1NPC1RAB9A
SCHEMBL30572439 0.72 NPC1 (0.49) KMT2APOLBNPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497201-B1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO KK (JP) 1997-01-15 EP disclosed
US-5478835-A Acyl coenzyme A: acyltransferase inhibitors; treatment of hyperlipemia and arteriosclerosis KYOWA HAKKO KOGYO CO., LTD. (JP) 1995-12-26 US disclosed
US-5340807-A Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-08-23 US disclosed
EP-0497201-A1 Tricyclic compounds and intermediates thereof KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-08-05 EP disclosed