SCHEMBL6760893

SCHEMBL6760893

COc1ccc(NC(=O)Nc2cccc(Br)c2)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
RAB9A P51151 3/20 0.60
HTT P42858 2/20 0.60
MAPT P10636 7/20 0.57
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
PKM P14618 2/20 0.57
TP53 P04637 1/20 0.57
TSHR P16473 1/20 0.57
TRPV1 Q8NER1 2/20 0.54
GAA P10253 1/20 0.53
NPC1 O15118 2/20 0.52
MITF O75030 1/20 0.50
KDR P35968 1/20 0.50

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
SCHEMBL6763008 0.85 CXCR2 (0.67) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6763526 0.85 MAPT (0.77) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6760907 0.85 DDX3X (0.59) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6765010 0.85 MEN1 (0.60) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6763521 0.85 FADS1 (0.64) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL4356025 0.84 TRPV1 (0.70) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6767742 0.84 MAPT (0.64) ALDH1A1RAB9AMAPTMEN1KMT2A
SCHEMBL23831504 0.81 MEN1 (0.57) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL6764102 0.81 CXCR1 (0.62) ALDH1A1RAB9AHTTMAPTMEN1
SCHEMBL1463349 0.81 GSK3A (0.66) ALDH1A1RAB9AHTTMAPTMEN1

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
US-20040063742-A1 Treatment of parkinson's disease by the combined action of a compound with neurotrophic activity and a compound enhancing the dopamine activity NEUROSEARCH A/S (DK) 2004-04-01 US claimed
US-20040063742-A1 Treatment of parkinson's disease by the combined action of a compound with neurotrophic activity and a compound enhancing the dopamine activity NEUROSEARCH A/S (DK) 2004-04-01 US disclosed