SCHEMBL10979205

SCHEMBL10979205

O=C1CN(CCCCBr)C(=O)N1Cc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 8/20 0.56
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ POLB P06746 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ BLM P54132 1/20 0.55
▸ F2 P00734 1/20 0.46
▸ PLG P00747 1/20 0.46
▸ ELANE P08246 1/20 0.46
▸ CTSG P08311 1/20 0.46
▸ CMA1 P23946 1/20 0.46
▸ CTRC Q99895 1/20 0.46
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ GSK3A P49840 4/20 0.42
▸ GSK3B P49841 4/20 0.42

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
SCHEMBL10983050 0.99 MEN1 (0.57) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL10978069 0.99 MEN1 (0.57) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL10979108 0.96 HDAC6 (0.54) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL10976738 0.87 MEN1 (0.56) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL27952145 0.84 HDAC6 (0.54) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL4872269 0.84 HDAC6 (0.54) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL4955033 0.81 HDAC6 (0.69) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL13987064 0.81 HDAC6 (0.54) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL7453553 0.75 HDAC6 (0.61) HDAC6MEN1KMT2APOLBKDM4E
SCHEMBL11650145 0.73 HDAC6 (0.60) HDAC6MEN1KMT2APOLBKDM4E

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
EP-0060610-B1 HEXAHYDRO-TRANS- AND TETRAHYDROPYRIDOINDOLE NEUROLEPTIC AGENTS PFIZER INC. (US) 1985-09-04 — — EP disclosed
US-4432978-A NEUROLEPTIC AGENTS, TRANQUILIZERS PFIZER INC. (US) 1984-02-21 — — US disclosed
US-4431649-A TRANQUILIZERS PFIZER INC. (US) 1984-02-14 — — US disclosed
US-4431646-A TRANQUILIZERS; PSYCHOSIS; NERVOUS SYSTEM DISORDERS PFIZER INC. (US) 1984-02-14 — — US disclosed
US-4427679-A TRANQUILIZERS; PSYCHOLOGICAL DISORDERS PFIZER INC. (US) 1984-01-24 — — US disclosed
US-4337250-A NEUROLEPTIC AGENTS PFIZER INC. (US) 1982-06-29 — — US disclosed
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