SCHEMBL29108917

SCHEMBL29108917

COC(=O)CC1CCCN1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ POLB P06746 2/20 0.35
▸ BRD4 O60885 1/20 0.34
▸ HDAC8 Q9BY41 2/20 0.34
▸ HDAC6 Q9UBN7 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GLP1R P43220 1/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL26207994 1.00 CHRM3 (0.43) CHRM3L3MBTL1POLBBRD4HDAC8
SCHEMBL26997852 0.90 BRD4 (0.36) CHRM3L3MBTL1POLBBRD4MEN1
SCHEMBL27428417 0.85 CHRM3 (0.39) CHRM3L3MBTL1POLBSMN1; SMN2CYP3A4
SCHEMBL26724232 0.83 CHRM3 (0.38) CHRM3L3MBTL1MEN1KMT2AMAPT
SCHEMBL26209176 0.82 CHRM3 (0.38) CHRM3L3MBTL1HTTSMN1; SMN2GLP1R
SCHEMBL26999907 0.81 CHRM3 (0.45) CHRM3L3MBTL1POLBHDAC8HDAC6
SCHEMBL24579154 0.81 CHRM3 (0.42) CHRM3L3MBTL1POLBFFAR1
SCHEMBL10021553 0.81 CHRM3 (0.42) CHRM3L3MBTL1POLBFFAR1
SCHEMBL24577997 0.81 CHRM3 (0.40) CHRM3L3MBTL1POLBHTTGLP1R
SCHEMBL26728235 0.81 CHRM3 (0.42) CHRM3L3MBTL1POLBFFAR1

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
CN-116802184-A Pyrazolothiazole carboxamides and their use as PDGFR inhibitors 埃科特莱茵药品有限公司 2023-09-22 — — CN disclosed
Send feedback