SCHEMBL13997752

SCHEMBL13997752

OCc1cccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cccc(CO)n3)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
RAB9A P51151 1/20 0.44
CYP19A1 P11511 1/20 0.41
TRPV3 Q8NET8 2/20 0.40
NOTUM Q6P988 2/20 0.40
MCL1 Q07820 2/20 0.38
THRB P10828 1/20 0.36
TGFBR1 P36897 1/20 0.36
CTRC Q99895 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2B P29275 1/20 0.36
ADORA1 P30542 1/20 0.36
LTB4R Q15722 2/20 0.35
ESR1 P03372 3/20 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
SCHEMBL8755666 0.92 MEN1 (0.45) MEN1KMT2ARAB9ACYP19A1TRPV3
SCHEMBL12532365 0.83 MEN1 (0.44) MEN1KMT2ARAB9ACYP19A1TRPV3
SCHEMBL8596986 0.83 ABL1 (0.44) RAB9AMCL1ALDH1A1ADORA3LTB4R
SCHEMBL2953474 0.82 MEN1 (0.60) MEN1KMT2ARAB9ATRPV3NOTUM
SCHEMBL9145225 0.82 CCR1 (0.46) MEN1KMT2ARAB9ATRPV3NOTUM
SCHEMBL14008677 0.81 MYC (0.44) MEN1KMT2ARAB9AMCL1ALDH1A1
SCHEMBL16588099 0.80 CCR1 (0.48) MEN1KMT2ARAB9ATRPV3NOTUM
SCHEMBL7772129 0.79 SYK (0.46) RAB9ATGFBR1ADORA3ADORA1
SCHEMBL28397411 0.79 ADORA1 (0.46) MEN1KMT2ACYP19A1NOTUMMCL1
SCHEMBL12546074 0.78 MEN1 (0.39) MEN1KMT2ARAB9ACYP19A1TRPV3

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-7465747-B2 Fluorescent label compounds Matsumoto, Kazuko (JP) 2008-12-16 US disclosed
US-7465747-B2 Fluorescent label compounds Matsumoto, Kazuko (JP) 2008-12-16 US disclosed