SCHEMBL30779407

SCHEMBL30779407

COC(=O)c1cnc(C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)s1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 7/20 0.45
GLS O94925 4/20 0.44
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
PIK3CD O00329 1/20 0.43
FAAH O00519 1/20 0.43
ACKR3 P25106 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
USP30 Q70CQ3 1/20 0.42
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42

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
SCHEMBL30779406 1.00 GPR119 (0.45) GPR119GLSIDO1TDO2PIK3CD
SCHEMBL30779497 1.00 GPR119 (0.45) GPR119GLSIDO1TDO2PIK3CD
SCHEMBL30779678 0.92 NR1H2 (0.42) GPR119GLSFAAHACKR3USP30
SCHEMBL30779423 0.79 DRD2 (0.40) KDM4E
SCHEMBL30779498 0.78 HRH3 (0.42) GPR119
SCHEMBL25189343 0.78 GPR119 (0.53) GPR119IDO1TDO2PIK3CDKDM4E
SCHEMBL30234556 0.78 GPR119 (0.53) GPR119IDO1TDO2PIK3CDKDM4E
SCHEMBL14164236 0.78 GPR119 (0.48) GPR119KDM4E
SCHEMBL23791421 0.77 GPR119 (0.55) GPR119IDO1TDO2PIK3CDFAAH
SCHEMBL8618357 0.77 GLS (0.48) GPR119GLSFAAHKDM4EPKM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573092-A1 2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE DERIVATIVES AS ESTROGEN RECEPTOR MODULATORS FOR THE TREATMENT OF CANCER Olema Pharmaceuticals, Inc. (US) 2025-06-25 EP disclosed
WO-2024039860-A1 2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE DERIVATIVES AS ESTROGEN RECEPTOR MODULATORS FOR THE TREATMENT OF CANCER OLEMA PHARMACEUTICALS, INC. (US) 2024-02-22 WO disclosed