SCHEMBL29909885

SCHEMBL29909885

CNc1nc2ccccc2s1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.66
NPC1 O15118 13/20 0.61
RAB9A P51151 13/20 0.61
SMN1; SMN2 Q16637 11/20 0.61
KMT2A Q03164 6/20 0.61
MAPT P10636 5/20 0.61
MEN1 O00255 5/20 0.61
CASP3 P42574 1/20 0.61
SENP8 Q96LD8 1/20 0.61
SENP7 Q9BQF6 1/20 0.61
SENP6 Q9GZR1 1/20 0.61
ADORA1 P30542 1/20 0.61
DYRK1A Q13627 1/20 0.61
GAA P10253 3/20 0.57
CYP1A2 P05177 1/20 0.57
ALDH1A1 P00352 3/20 0.56
NFKB1 P19838 3/20 0.56
NFKB2 Q00653 3/20 0.56
RELA Q04206 3/20 0.56
LMNA P02545 2/20 0.56

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
SCHEMBL758888 1.00 IDO1 (0.66) IDO1NPC1RAB9ASMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL3130678 0.98 IDO1 (0.63) IDO1NPC1RAB9ASMN1; SMN2KMT2A
Maleic Acid SCHEMBL28252571 0.85 ADORA1 (0.59) IDO1NPC1RAB9ASMN1; SMN2KMT2A
Succinic Acid SCHEMBL28231097 0.85 POLB (0.72) NPC1RAB9ASMN1; SMN2KMT2AMAPT
SCHEMBL27958892 0.84 GAA (0.63) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3112891 0.83 NPC1 (0.78) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL30073965 0.83 NPC1 (0.78) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL3266299 0.82 NPC1 (0.71) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL29973968 0.80 IDO1 (0.61) IDO1NPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL28878461 0.80 IDO1 (0.61) IDO1NPC1RAB9ASMN1; SMN2KMT2A

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
CN-119591500-A Preparation of linear acrylate monomer based on side chain and retardation film thereof 杉金光电(南京)有限公司 2025-03-11 CN disclosed
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
WO-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed
CN-111655672-B Method for producing 1, 1-disubstituted hydrazine compound and method for producing polymerizable compound 日本瑞翁株式会社 2023-05-12 CN disclosed
EP-4081305-A1 DIACYLGLYCEROL KINASE MODULATING COMPOUNDS Carna Biosciences, Inc. (JP) 2022-11-02 EP disclosed