SCHEMBL24316417

SCHEMBL24316417

COc1ccccc1CCOc1ncc(O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.47
ABCB1 P08183 4/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALOX5 P09917 1/20 0.43
MPO P05164 2/20 0.42
PDE2A O00408 1/20 0.41
IDO1 P14902 2/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
SIGMAR1 Q99720 1/20 0.40
AOC3 Q16853 1/20 0.40

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
SCHEMBL24316412 0.84 CYP11B1 (0.48) ALOX5SIGMAR1
SCHEMBL24316419 0.80 PDGFRB (0.49)
SCHEMBL24316421 0.78 CALM1 (0.47) TAAR1MEN1KMT2A
SCHEMBL24316416 0.77 TAAR1 (0.49) TAAR1ABCB1ALOX5
SCHEMBL324131 0.73 CYP3A4 (0.46) ALOX5
SCHEMBL21327653 0.72 CSF1R (0.54)
SCHEMBL24316420 0.72 MAOB (0.45)
SCHEMBL24316985 0.71 MRGPRX4 (0.49) MEN1KMT2A
SCHEMBL30682056 0.71 CSF1R (0.42) TAAR1IDO1
SCHEMBL24316986 0.71 KDM4E (0.50) MEN1KMT2A

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
WO-2022057895-A1 HETEROAROMATIC COMPOUNDS AND USES THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2022-03-24 WO disclosed
US-9585884-B2 Pyrimidinone inhibitors of lipoprotein-associated phospholipase A2 AUSPEX PHARMACEUTICALS, INC. (US) 2017-03-07 US disclosed