SCHEMBL6800698

SCHEMBL6800698

N#Cc1ccc(NC(=O)c2ccc(O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.68
MEN1 O00255 1/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
KMT2A Q03164 1/20 0.61
DEGS1 O15121 2/20 0.58
SNCA P37840 1/20 0.58
NAMPT P43490 2/20 0.58
CYP11B1 P15538 1/20 0.57
CYP11B2 P19099 1/20 0.57
NQO2 P16083 2/20 0.56
ESR1 P03372 1/20 0.56
CA12 O43570 1/20 0.55
CA2 P00918 1/20 0.55
CA3 P07451 1/20 0.55
CA6 P23280 1/20 0.55
CA9 Q16790 1/20 0.55
CA14 Q9ULX7 1/20 0.55
TAS1R3 Q7RTX0 1/20 0.54
TAS1R1 Q7RTX1 1/20 0.54

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
SCHEMBL7272760 1.00 MLYCD (0.68) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL9337665 0.93 MLYCD (0.76) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL6263516 0.93 MLYCD (0.76) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL15482261 0.86 MLYCD (0.68) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL20764458 0.86 MLYCD (0.68) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL31311100 0.86 MLYCD (0.68) MLYCDMEN1NPC1RAB9AKMT2A
SCHEMBL899585 0.85 DEGS1 (0.75) MEN1NPC1RAB9AKMT2ADEGS1
SCHEMBL900928 0.85 DEGS1 (0.75) MEN1NPC1RAB9AKMT2ADEGS1
SCHEMBL8420639 0.85 DEGS1 (0.75) MEN1NPC1RAB9AKMT2ADEGS1
SCHEMBL20379456 0.85 MEN1 (0.73) MLYCDMEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed
EP-0483667-B1 Cyclic imino derivatives, process for their preparation and drugs containing them THOMAE GMBH DR K (DE) 1998-02-04 EP disclosed
US-5591769-A PYRROLIDINE DERIVATIVES; ANTICOAGULANTS KARL THOMAE GMBH (DE) 1997-01-07 US disclosed
US-5541343-A ANTIAGGLOMERANTS FOR CELLS OR ANTICOAGULANTS KARL THOMAE GMBH (DE) 1996-07-30 US disclosed
EP-0483667-A2 Cyclic imino derivatives, process for their preparation and drugs containing them Dr. Karl Thomae GmbH (DE) 1992-05-06 EP disclosed