SCHEMBL11296858

SCHEMBL11296858

OOC(c1ccccc1)(c1ccccc1)c1ccc(Oc2ccc(C(OO)(c3ccccc3)c3ccccc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.46
NR1H2 P55055 1/20 0.46
BAX Q07812 1/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
PARP10 Q53GL7 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MAOA P21397 1/20 0.41
PGR P06401 1/20 0.39
SRD5A2 P31213 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP13 P45452 1/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL297104 0.86 ALDH1A1 (0.56) TSHRALDH1A1ALOX15MEN1KMT2A
SCHEMBL19620174 0.83 CA4 (0.50) LTA4HALDH1A1ALOX15CA1CA2
SCHEMBL8715862 0.77 LTA4H (0.55) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL25862884 0.75 LTA4H (0.60) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL11226988 0.73 ALDH1A1 (0.58) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL11745214 0.73 LTA4H (0.50) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL10760022 0.73 ALDH1A1 (0.58) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL21118545 0.71 LTA4H (0.55) LTA4HNR1H2BAXTSHRPARP10
SCHEMBL9248118 0.71 ALDH1A1 (0.56) LTA4HNR1H2BAXTSHRALDH1A1
SCHEMBL11481229 0.71 ALDH1A1 (0.42) TSHRALDH1A1ALOX15SRD5A2ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4363894-A Glass reinforced polyamide compositions having improved impact strengths RHONE-POULENC INDUSTRIES (FR) 1982-12-14 US disclosed