SCHEMBL22462386

SCHEMBL22462386

CC(C)C1CCCC(NC(=O)c2cc(C(N)=O)cc(C(N)=O)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 9/20 0.44
NPC1 O15118 4/20 0.43
RAB9A P51151 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
HPGD P15428 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
GAA P10253 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM1A O60341 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
F2 P00734 1/20 0.38
PLG P00747 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38

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
SCHEMBL2450300 0.93 GRM5 (0.49) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL22462380 0.87 GRM5 (0.40) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL22462374 0.84 SMYD3 (0.46) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL22462397 0.82 CYP2D6 (0.43) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL10210882 0.80 GRM5 (0.59) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL2449968 0.79 GRM5 (0.45) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL2229042 0.79 KMT2A (0.59) NPC1RAB9ASMN1; SMN2HPGDMEN1
SCHEMBL22462454 0.78 TSHR (0.43) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL22462388 0.76 TSHR (0.42) GRM5NPC1RAB9ASMN1; SMN2HPGD
SCHEMBL22462407 0.76 TAS1R3 (0.47) MEN1KMT2A

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
EP-3715092-A1 DECORATIVE FILM AND METHOD FOR MANUFACTURING DECORATIVE MOLDED ARTICLE USING SAME Japan Polypropylene Corporation (JP) 2020-09-30 EP disclosed