SCHEMBL10974005

SCHEMBL10974005

CCC(Br)CCCCCCN1CCCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.39
RAB9A P51151 1/20 0.38
ADRA1B P35368 5/20 0.38
ADRA1A P35348 2/20 0.36
KMT2A Q03164 4/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MALT1 Q9UDY8 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL10977910 0.85 PIK3CD (0.45) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL9319724 0.83 GAA (0.42) PIK3CDRAB9AKMT2AMEN1L3MBTL1
SCHEMBL628723 0.80 PIK3CD (0.50) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL9812335 0.80 PIK3CD (0.50) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL9319736 0.80 GAA (0.42) PIK3CDRAB9AKMT2AMEN1L3MBTL1
SCHEMBL24072918 0.79 ALOX5 (0.47) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL3732638 0.79 ALOX5 (0.47) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL245238 0.79 ALOX5 (0.47) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL10792403 0.79 ALOX5 (0.47) PIK3CDRAB9AADRA1BADRA1AKMT2A
SCHEMBL31602012 0.79 ALOX5 (0.47) PIK3CDRAB9AADRA1BADRA1AKMT2A

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 7 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
EP-0060610-A1 Hexahydro-trans- and tetrahydropyridoindole neuroleptic agents PFIZER INC. (US) 1982-09-22 EP disclosed
US-4337250-A NEUROLEPTIC AGENTS PFIZER INC. (US) 1982-06-29 US disclosed