SCHEMBL30711307

SCHEMBL30711307

COC(=O)c1ccccc1C1CC(c2ccc(Cl)cn2)CCN1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ SLC6A3 Q01959 4/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ GRM2 Q14416 1/20 0.35
▸ LMNA P02545 4/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ ABL1 P00519 1/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ PDK4 Q16654 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ MAPK10 P53779 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
SCHEMBL30711365 0.88 SLC6A4 (0.39) ALDH1A1SLC6A3SLC6A4LMNAHTT
SCHEMBL30711313 0.80 KDM4E (0.42) ALDH1A1LMNANPSR1NPC1HTT
SCHEMBL31465108 0.76 HDAC3 (0.38) ALDH1A1SLC6A3GRM2LMNANPSR1
SCHEMBL31465168 0.76 POLB (0.36) ALDH1A1SLC6A3GRM2LMNANPSR1
SCHEMBL31465088 0.75 PDK2 (0.36) ALDH1A1SLC6A3LMNANPSR1POLB
SCHEMBL31465003 0.75 NPSR1 (0.42) ALDH1A1GRM2NPSR1L3MBTL1NPC1
SCHEMBL31465073 0.74 PDK2 (0.35) ALDH1A1SLC6A3LMNANPSR1SMN1; SMN2
SCHEMBL31465095 0.69 ATM (0.37) ALDH1A1MAPK1NPC1HTTRAB9A
SCHEMBL30933381 0.69 EPHX2 (0.38) ALDH1A1SLC6A3GRM2LMNANPSR1
SCHEMBL4431279 0.68 HTR2C (0.55) ALDH1A1SLC6A3SLC6A4LMNANPSR1

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
CN-119698414-A Indole-phenyl piperidine compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2025-03-25 — — CN disclosed
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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