SCHEMBL28599569

SCHEMBL28599569

CCCC(=O)N(CCN1CCC(Oc2ccccc2)CC1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.58
▸ OPRM1 P35372 10/20 0.55
▸ PTGIR P43119 5/20 0.52
▸ SIGMAR1 Q99720 2/20 0.51
▸ CARM1 Q86X55 1/20 0.50
▸ PRMT6 Q96LA8 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL28599365 0.93 OPRM1 (0.59) TP53OPRM1PTGIR
SCHEMBL28602018 0.91 OPRM1 (0.67) OPRM1PTGIRSIGMAR1CARM1PRMT6
SCHEMBL28597470 0.86 PTGIR (0.56) OPRM1PTGIRSIGMAR1CARM1PRMT6
SCHEMBL28602839 0.84 OPRM1 (0.70) OPRM1SIGMAR1
SCHEMBL28613676 0.79 ACHE (0.57) OPRM1PTGIRCARM1PRMT6
SCHEMBL20328148 0.76 CARM1 (0.70) CARM1PRMT6SMN1; SMN2
SCHEMBL27629597 0.73 CARM1 (0.65) CARM1PRMT6
SCHEMBL29186126 0.72 OPRM1 (0.58) TP53OPRM1SIGMAR1SMN1; SMN2
SCHEMBL29186101 0.72 TP53 (0.53) TP53OPRM1SIGMAR1
SCHEMBL11175459 0.72 CARM1 (0.57) SIGMAR1CARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113214140-B Piperidine amide derivative, pharmaceutical composition and application thereof 江苏谛奇医药科技有限公司 2022-09-09 — — CN claimed
CN-113214140-A Piperidine amide derivative, pharmaceutical composition and application thereof 江苏谛奇医药科技有限公司 2021-08-06 — — CN claimed
CN-113214140-B Piperidine amide derivative, pharmaceutical composition and application thereof 江苏谛奇医药科技有限公司 2022-09-09 — — CN disclosed
CN-113214139-B Piperidine amide derivative, preparation method thereof, pharmaceutical composition thereof, single crystal culture method thereof and application thereof 江苏谛奇医药科技有限公司 2022-03-04 — — CN disclosed
CN-113214140-A Piperidine amide derivative, pharmaceutical composition and application thereof 江苏谛奇医药科技有限公司 2021-08-06 — — CN disclosed
CN-113214139-A Piperidine amide derivative, preparation method thereof, pharmaceutical composition thereof, single crystal culture method thereof and application thereof 江苏谛奇医药科技有限公司 2021-08-06 — — CN disclosed
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