SCHEMBL9080255

SCHEMBL9080255

O=C1C=C(c2cccc(Sc3ccc(F)cc3)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
P4HB P07237 1/20 0.35
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ANXA2 P07355 1/20 0.33
S100A10 P60903 1/20 0.33
MGLL Q99685 1/20 0.32
PTPN1 P18031 1/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
BCL2 P10415 1/20 0.32
MCL1 Q07820 1/20 0.32
MAPT P10636 1/20 0.32
DHODH Q02127 1/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL9081715 0.88 L3MBTL1 (0.39) L3MBTL1ATMP4HBMEN1KMT2A
SCHEMBL9081969 0.81 MEN1 (0.32) P4HBMEN1KMT2AALDH1A1NPSR1
SCHEMBL9081691 0.75 MEN1 (0.33) MEN1KMT2AALDH1A1NPSR1MAPT
SCHEMBL9081708 0.73 MEN1 (0.31) MEN1KMT2AALDH1A1NPSR1
SCHEMBL9081711 0.73 MEN1 (0.31) MEN1KMT2AALDH1A1NPSR1
SCHEMBL9080631 0.72 MEN1 (0.35) P4HBMEN1KMT2AALDH1A1NPSR1
SCHEMBL9226766 0.71 MGLL (0.34) L3MBTL1ATMMEN1KMT2AALDH1A1
SCHEMBL7938436 0.70 HAO1 (0.49) MEN1KMT2AALDH1A1NPSR1MAOA
SCHEMBL9081519 0.70 ALOX5 (0.38) MEN1KMT2AALDH1A1MGLLMAPT
SCHEMBL10549354 0.70 MEN1 (0.39) P4HBMEN1KMT2AALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736006-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1996-10-09 EP disclosed
WO-1995017379-A1 PHENYLTHIOPHENYL CYCLOALKENYL HYDROXYUREAS AS LIPOXYGENASE INHIBITORS PFIZER INC. (US) 1995-06-29 WO disclosed