SCHEMBL18403872

SCHEMBL18403872

O=Nc1ccc(O)c(Br)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.50
▸ BRD4 O60885 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ PRMT1 Q99873 1/20 0.41
▸ AMY1A P0DUB6 1/20 0.40
▸ CA12 O43570 3/20 0.39
▸ CA1 P00915 3/20 0.39
▸ CA2 P00918 3/20 0.39
▸ CA9 Q16790 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ BLVRB P30043 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PTGS1 P23219 2/20 0.36
▸ PTGS2 P35354 2/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL28209807 0.78 ALDH1A1 (0.36) ALOX15ALDH1A1HSD17B10MEN1HTT
SCHEMBL3316934 0.78 PTGS2 (0.48) ALOX15CA12CA1CA2CA9
SCHEMBL12228262 0.74 MAPT (0.40) ALOX15CA1CA2ALDH1A1HSD17B10
SCHEMBL20436095 0.74 GLB1 (0.59) ALOX15BRD4CA12CA2CA9
SCHEMBL11213671 0.73 PTGS1 (0.53) BRD4CA1CA2ALDH1A1HSD17B10
SCHEMBL19381131 0.73 IDO1 (0.45) —
SCHEMBL14075868 0.73 ALDH1A1 (0.33) ALOX15ALDH1A1HSD17B10MEN1HTT
SCHEMBL639211 0.73 RAB9A (0.52) ALOX15BRD4ALOX12ALDH1A1HSD17B10
SCHEMBL12458453 0.73 MEN1 (0.40) ALOX15ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL798232 0.73 HSD17B10 (0.41) ALDH1A1HSD17B10MEN1PDE4ABLVRB

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-2017159484-A1 2,4-DIAMINOPHENOL DERIVATIVE, AND AGENT FOR INHIBITING AGGREGATION OF TAU AND/OR AMYLOID β 学校法人同志社 2017-09-21 — — WO disclosed
EP-2401392-B1 SOLUTION PHASE HOMOGENEOUS ASSAYS BECKMAN COULTER INC (US) 2017-01-25 — — EP disclosed
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