SCHEMBL8615975

SCHEMBL8615975

O=C1CCCc2cc(Br)c(Br)cc21

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
MAPK1 P28482 1/20 0.55
KMT2A Q03164 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MAOA P21397 14/20 0.50
MAOB P27338 14/20 0.50
PRKCI P41743 1/20 0.50
CYP2A6 P11509 1/20 0.47
HSD17B1 P14061 2/20 0.44
GRM5 P41594 1/20 0.42
BAZ2B Q9UIF8 1/20 0.41
CDC25B P30305 1/20 0.35

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
SCHEMBL31591224 0.86 PBRM1 (0.47) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL23051659 0.86 PBRM1 (0.47) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL15689674 0.84 MAOA (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL21155472 0.84 MAPK1 (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL16858594 0.84 MAPK1 (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL23782883 0.84 MEN1 (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL15689518 0.84 MEN1 (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL21772243 0.84 MEN1 (0.49) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL30811403 0.84 MAOA (0.53) MEN1MAPK1KMT2ANPSR1MAOA
SCHEMBL29181736 0.84 MAOA (0.53) MEN1MAPK1KMT2ANPSR1MAOA

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
US-5753655-A PROGESTINS OR ANTIPROGESTINS ORTHO PHARMACEUTICAL CORPORATION (US) 1998-05-19 US disclosed