SCHEMBL9821067

SCHEMBL9821067

CCC(=O)c1ccc(NC(C)=O)cc1F

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.69
NPC1 O15118 4/20 0.64
RAB9A P51151 5/20 0.57
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
HDAC1 Q13547 2/20 0.55
NR4A1 P22736 1/20 0.53
TSHR P16473 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
PREP P48147 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 1/20 0.46
RORC P51449 1/20 0.43

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
SCHEMBL15578387 0.88 NPC1 (0.57) POLBNPC1RAB9ACASP3SENP8
SCHEMBL2980484 0.86 NPC1 (0.59) POLBNPC1RAB9ACASP3SENP8
SCHEMBL7765889 0.85 POLB (0.76) POLBNPC1RAB9ANR4A1TSHR
SCHEMBL11263717 0.83 NPC1 (0.56) POLBNPC1RAB9ACASP3SENP8
SCHEMBL2983642 0.83 HDAC1 (0.60) POLBNPC1RAB9ACASP3SENP8
SCHEMBL11235452 0.82 POLB (1.00) POLBNPC1RAB9ANR4A1TSHR
SCHEMBL1966151 0.81 HDAC1 (0.58) POLBNPC1RAB9ACASP3SENP8
SCHEMBL10965331 0.81 POLB (0.69) POLBNPC1RAB9ANR4A1TSHR
SCHEMBL16318414 0.80 NPC1 (0.56) POLBNPC1RAB9ACASP3SENP8
SCHEMBL2925453 0.80 HDAC1 (0.61) POLBNPC1RAB9ACASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014043715-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2014-03-20 WO disclosed
WO-2014043715-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2014-03-20 WO disclosed
EP-0224001-B1 ANTHRANILONITRILE DERIVATIVES AND RELATED COMPOUNDS AS USEFUL AGENTS FOR PROMOTING GROWTH, IMPROVING FEED EFFICIENCY, AND FOR INCREASING THE LEAN MEAT TO FAT RATIO OF WARM-BLOODED ANIMALS AMERICAN CYANAMID COMPANY (US) 1991-03-20 EP disclosed
US-4863959-A Anthranilonitrile derivatives as useful agents for promoting growth, improving feed efficiency, and for increasing the lean meat to fat ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1989-09-05 US disclosed
EP-0224001-A1 Anthranilonitrile derivatives and related compounds as useful agents for promoting growth, improving feed efficiency, and for increasing the lean meat to fat ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1987-06-03 EP disclosed