SCHEMBL11207722

SCHEMBL11207722

Cc1cccc(-c2cccc(C)c2Cc2ccccc2)c1C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CALM1 P0DP23 1/20 0.39
HTR7 P34969 2/20 0.37
POLB P06746 1/20 0.36
P2RX7 Q99572 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL11212389 0.89 NPC1 (0.47) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL2991545 0.83 HTR7 (0.45) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL7918609 0.82 CALM1 (0.52) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL9066733 0.78 IDH1 (0.49) IDH1SMN1; SMN2HPGDMAPK1CALM1
SCHEMBL31345536 0.78 IDH1 (0.49) IDH1SMN1; SMN2HPGDMAPK1CALM1
SCHEMBL29532678 0.76 IDH1 (0.47) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL146769 0.76 IDH1 (0.47) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL9719201 0.76 IDH1 (0.47) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL11201347 0.75 PDCD1 (0.40) IDH1NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL218508 0.74 TRPA1 (0.52) NPC1RAB9ASMN1; SMN2POLBP2RX7

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-4371726-A Composition suitable for mechanical power transmission and process for operating traction drives NIPPON STEEL CHEMICAL CO., LTD. (JP) 1983-02-01 US disclosed