SCHEMBL30711374

SCHEMBL30711374

O=C(O)c1ccc([C@@H]2CC(c3ncccn3)CCN2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SLC6A7 Q99884 1/20 0.35
▸ HCAR3 P49019 3/20 0.35
▸ KDM4E B2RXH2 3/20 0.34
▸ GLA P06280 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ CAMKK2 Q96RR4 1/20 0.33
▸ LTA4H P09960 1/20 0.33
▸ HNF4A P41235 1/20 0.33
▸ P2RY14 Q15391 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL30711256 0.86 ESR1 (0.40) KDM4EJAK2
SCHEMBL29149002 0.86 ESR1 (0.40) KDM4EJAK2
SCHEMBL31465089 0.85 KDM4E (0.41) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL30711225 0.85 KDM4E (0.41) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL30711259 0.83 AKR1C3 (0.44) P2RY14
SCHEMBL30711292 0.83 P2RY14 (0.42) KDM4EKMT2ALTA4HP2RY14LMNA
SCHEMBL30711273 0.81 CHRNB2 (0.51) HCAR3KDM4EKMT2ASMN1; SMN2L3MBTL1
SCHEMBL30711353 0.80 CAMKK2 (0.35) KDM4EGLAHTTKMT2ASMN1; SMN2
SCHEMBL30711200 0.80 KDM5A (0.34) P2RY14
SCHEMBL30711285 0.80 HCAR2 (0.39) HCAR3KMT2ASMN1; SMN2P2RY14

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-2023246677-A1 INDOLE-PHENYLPIPERIDINE COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 深圳信立泰药业股份有限公司 2023-12-28 — — WO disclosed
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