SCHEMBL26523249

SCHEMBL26523249

O=C(NC1CCNCC1)C1(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 6/20 0.53
▸ SSTR1 P30872 4/20 0.53
▸ LMNA P02545 1/20 0.49
▸ EPHX1 P07099 3/20 0.46
▸ POLB P06746 2/20 0.46
▸ AVPR1A P37288 2/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ CHRM1 P11229 1/20 0.40
▸ CHRM3 P20309 1/20 0.40
▸ FPR3 P25089 1/20 0.40
▸ FPR2 P25090 1/20 0.40
▸ TEAD1 P28347 1/20 0.40
▸ HPGD P15428 1/20 0.40

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
SCHEMBL26523084 0.86 SSTR4 (0.49) SSTR4SSTR1LMNAEPHX1FPR3
SCHEMBL26523155 0.86 SSTR4 (0.70) SSTR4SSTR1CHRM1CHRM3HPGD
SCHEMBL26127751 0.80 SSTR4 (0.78) SSTR4SSTR1POLB
SCHEMBL26124582 0.80 SSTR4 (0.72) SSTR4SSTR1CHRM1FPR2
SCHEMBL652791 0.79 LMNA (0.79) LMNAEPHX1POLBCHRM1CHRM3
SCHEMBL14624528 0.78 EPHX1 (0.74) LMNAEPHX1POLBFPR3FPR2
SCHEMBL7919878 0.77 EPHX1 (0.50) SSTR4SSTR1EPHX1HPGD
Hydrochloric Acid SCHEMBL6473105 0.77 LMNA (0.77) LMNAEPHX1POLBCHRM1CHRM3
Trifluoroacetic Acid SCHEMBL30601829 0.75 SSTR4 (0.64) SSTR4SSTR1CHRM1
Trifluoroacetic Acid SCHEMBL30601817 0.74 SSTR4 (0.69) SSTR4SSTR1CHRM1

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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