SCHEMBL31505245

SCHEMBL31505245

O=C(Nc1ccc(Nc2ccc(Cl)cc2)cc1)c1ccccc1CN1CCC(N2CCCCC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ TSHR P16473 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ NR3C1 P04150 2/20 0.48
▸ KDR P35968 3/20 0.47
▸ FLT1 P17948 2/20 0.47
▸ LMNA P02545 2/20 0.45
▸ MAPT P10636 3/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ TRPV4 Q9HBA0 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.44
▸ AVPR2 P30518 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ACKR3 P25106 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
SCHEMBL31505243 0.90 ALDH1A1 (0.50) L3MBTL1ALDH1A1TSHRRECQLLMNA
SCHEMBL31505242 0.88 ACKR3 (0.46) L3MBTL1ALDH1A1TSHRRECQLLMNA
SCHEMBL31505241 0.87 ALDH1A1 (0.58) L3MBTL1ALDH1A1TSHRRECQLKDR
SCHEMBL31520444 0.83 NPC1 (0.61) L3MBTL1ALDH1A1LMNARAB9AKDM4E
SCHEMBL31520469 0.76 RAB9A (0.53) L3MBTL1LMNARAB9AACKR3
SCHEMBL23014109 0.76 L3MBTL1 (0.51) L3MBTL1ALDH1A1TSHRRECQLKDM4E
SCHEMBL29733708 0.76 L3MBTL1 (0.51) L3MBTL1ALDH1A1TSHRRECQLKDM4E
SCHEMBL31520466 0.74 TNF (0.58) L3MBTL1ALDH1A1LMNAMAPTRAB9A
SCHEMBL31520463 0.74 RAB9A (0.62) L3MBTL1ALDH1A1MAPK1RAB9ASMN1; SMN2
SCHEMBL31520448 0.74 NPC1 (0.62) L3MBTL1ALDH1A1LMNAMAPK1RAB9A

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
CN-119874605-A Benzoyl piperidinyl piperidine derivatives, preparation method and application thereof 南通大学 2025-04-25 — — CN disclosed
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