SCHEMBL8296637

SCHEMBL8296637

O=C(Nc1ccc(F)cc1)C1CCCCC1

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.74
▸ RAB9A P51151 5/20 0.72
▸ NPC1 O15118 3/20 0.72
▸ HPGD P15428 1/20 0.69
▸ ENPP3 O14638 3/20 0.68
▸ ENPP1 P22413 2/20 0.68
▸ ENPP2 Q13822 2/20 0.68
▸ KMT2A Q03164 1/20 0.67
▸ LMNA P02545 1/20 0.63
▸ MAPT P10636 1/20 0.63
▸ SMN1; SMN2 Q16637 1/20 0.63
▸ NPSR1 Q6W5P4 1/20 0.63
▸ PTPN2 P17706 1/20 0.61
▸ CCNA2 P20248 1/20 0.61
▸ CDK2 P24941 1/20 0.61
▸ EPHX1 P07099 1/20 0.61
▸ HDAC3 O15379 1/20 0.58
▸ HDAC1 Q13547 1/20 0.58
▸ HDAC2 Q92769 1/20 0.58

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
SCHEMBL42558 0.98 PTPN1 (0.71) PTPN1RAB9ANPC1HPGDENPP3
SCHEMBL10242579 0.95 KMT2A (0.69) PTPN1RAB9ANPC1HPGDENPP3
SCHEMBL14734057 0.91 KMT2A (0.78) PTPN1RAB9ANPC1ENPP3ENPP1
SCHEMBL28656982 0.91 PTPN1 (0.89) PTPN1RAB9ANPC1HPGDENPP3
SCHEMBL125695 0.91 PTPN1 (0.89) PTPN1RAB9ANPC1HPGDENPP3
Hydrochloric Acid SCHEMBL5794594 0.89 KMT2A (0.76) PTPN1RAB9ANPC1ENPP3ENPP1
SCHEMBL27840833 0.86 KMT2A (0.71) PTPN1RAB9ANPC1ENPP3ENPP1
SCHEMBL9851155 0.84 PTPN1 (0.77) PTPN1RAB9ANPC1HPGDENPP3
SCHEMBL29057710 0.84 PTPN1 (0.77) PTPN1RAB9ANPC1HPGDENPP3
Formamide SCHEMBL18488991 0.83 KMT2A (0.68) PTPN1RAB9ANPC1ENPP3ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213255-A Synthetic method of six-membered ring benzylamine compound 上海泰坦科技股份有限公司 2022-03-22 — — CN disclosed
EP-3215142-B1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2021-03-24 — — EP disclosed
EP-0898569-A1 PIPERIDINES AND PYRROLIDINES MERCK PATENT GmbH (DE) 1999-03-03 — — EP disclosed
WO-1997040038-A1 PIPERIDINES AND PYRROLIDINES MERCK PATENT GMBH (DE) 1997-10-30 — — WO disclosed
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