SCHEMBL23763183

SCHEMBL23763183

Cn1cc(-c2nc(Cl)cc(N3CC4(CCN(C(=O)OC(C)(C)C)CC4(F)F)C3)n2)cn1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 17/20 0.41
▸ PIK3CD O00329 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.39
▸ GPR119 Q8TDV5 1/20 0.39

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
SCHEMBL30746067 1.00 RET (0.41) RETPIK3CDLRRK2GPR119
SCHEMBL23763271 0.83 GPR119 (0.43) GPR119
SCHEMBL30746064 0.82 CYP11B2 (0.38) PIK3CDGPR119
SCHEMBL23763270 0.82 CYP11B2 (0.38) PIK3CDGPR119
SCHEMBL23763418 0.81 MAP3K12 (0.41) RETLRRK2
SCHEMBL29968218 0.81 MAP3K12 (0.41) RETLRRK2
SCHEMBL23763268 0.73 CCNC (0.46) RETGPR119
SCHEMBL29968457 0.73 PIK3CD (0.47) RETPIK3CD
SCHEMBL23763432 0.73 PIK3CD (0.47) RETPIK3CD
SCHEMBL29968589 0.69 MAP3K12 (0.47) —

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
WO-2021159993-A1 INHIBITORS OF INTERLEUKIN-1 RECEPTOR ASSOCIATED KINASE (IRAK) /FMS-LIKE RECEPTOR TYROSINE KINASE (FLT3), PHARMACEUTICAL PRODUCTS THEREOF, AND METHODS THEREOF PHARMABLOCK SCIENCES (NANJING) , INC. (CN) 2021-08-19 — — WO disclosed
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