SCHEMBL26523041

SCHEMBL26523041

CN1CCC(NC(=O)C2(Cc3ccc(F)cc3)CC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 7/20 0.58
▸ SSTR1 P30872 2/20 0.58
▸ HTR2A P28223 1/20 0.48
▸ ACKR3 P25106 1/20 0.47
▸ SIGMAR1 Q99720 2/20 0.44
▸ SLC6A5 Q9Y345 1/20 0.44
▸ MCHR1 Q99705 1/20 0.44
▸ CCR3 P51677 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ THRB P10828 1/20 0.43
▸ RECQL P46063 1/20 0.43

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
SCHEMBL26121996 0.82 SSTR4 (0.80) SSTR4SSTR1
SCHEMBL26121994 0.82 SSTR4 (0.80) SSTR4SSTR1
SCHEMBL26125218 0.82 SSTR4 (0.80) SSTR4SSTR1
SCHEMBL26523105 0.82 EPHX1 (0.48) SSTR4SSTR1ALDH1A1
SCHEMBL26523084 0.82 SSTR4 (0.49) SSTR4SSTR1ACKR3SIGMAR1
SCHEMBL4982545 0.79 MCHR1 (0.66) SSTR4HTR2AACKR3MCHR1CCR3
SCHEMBL26523074 0.78 SSTR4 (0.60) SSTR4SSTR1
SCHEMBL21748572 0.76 SSTR4 (0.53) SSTR4SSTR1SIGMAR1ALDH1A1
SCHEMBL20720786 0.75 SSTR4 (0.54) SSTR4HTR2AACKR3SIGMAR1SLC6A5
SCHEMBL30601831 0.74 SSTR4 (1.00) SSTR4SSTR1

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-2023187677-A1 N-(PYRROLIDIN-3-YL OR PIPERIDIN-4-YL)ACETAMIDE DERIVATIVES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-10-05 — — WO disclosed
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