SCHEMBL22754662

SCHEMBL22754662

Cc1ccccc1C1=CC=CC(C)C1N

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
HSP90AA1 P07900 1/20 0.31
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
BRD4 O60885 1/20 0.30
ACHE P22303 1/20 0.30

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
SCHEMBL21763810 0.77
SCHEMBL23450707 0.73 RAB9A (0.37) NPC1RAB9ASMN1; SMN2TSHRALDH1A1
SCHEMBL197690 0.67 ACHE (0.64) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL30354037 0.67 ACHE (0.64) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL30169568 0.67 ACHE (0.64) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL30810809 0.67 PBRM1 (0.31)
SCHEMBL21650454 0.67 GPR3 (0.31)
SCHEMBL20686377 0.67 NISCH (0.33) NPC1RAB9ASMN1; SMN2CASP3SENP8
SCHEMBL21118042 0.66
SCHEMBL8759828 0.66 NPC1 (0.32) NPC1RAB9ASMN1; SMN2CASP3SENP8

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-3748708-A1 ORGANIC LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2020-12-09 EP disclosed