SCHEMBL11060367

SCHEMBL11060367

Oc1cc(Cl)c2nc3cc(Cl)ccc3cc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.37
HSD17B10 Q99714 4/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 2/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HPGD P15428 1/20 0.34
CRHBP P24387 1/20 0.34
CRHR2 Q13324 1/20 0.34
NQO2 P16083 1/20 0.34
AR P10275 1/20 0.33
HTR3E A5X5Y0 1/20 0.33
HTR3B O95264 1/20 0.33

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
SCHEMBL11059553 0.81 ALDH1A1 (0.50) HSD17B10CYP3A4ALDH1A1ESR1ESR2
SCHEMBL16500490 0.75 ESR1 (0.49) NR4A2HSD17B10TSHRALDH1A1ESR1
SCHEMBL7608692 0.74 NR4A2 (0.52) NR4A2ALDH1A1PDGFRBPDGFRARXFP1
SCHEMBL17434591 0.72 HSD17B10 (0.41) HSD17B10CYP3A4ALDH1A1ESR1ESR2
SCHEMBL31081799 0.70 ALOX15 (0.42) NR4A2HSD17B10TSHRCYP3A4ALDH1A1
SCHEMBL11059176 0.68 CYP2A6 (0.42) HSD17B10TSHRCYP3A4ALDH1A1TDP1
SCHEMBL14720338 0.67 NR4A2 (0.50) NR4A2HSD17B10TSHRCYP3A4ALDH1A1
SCHEMBL29276998 0.67 ESR1 (0.61) NR4A2HSD17B10TSHRCYP3A4ALDH1A1
SCHEMBL17423219 0.66 MAPT (0.65) NR4A2ALDH1A1TDP1ESR1ESR2
SCHEMBL28208080 0.66 NR4A2 (0.44) NR4A2ALDH1A1PDGFRBPDGFRARXFP1

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-4452792-A Acridine substituted phosphorus compounds and their insecticidal use VELSICOL CHEMICAL CORPORATION (US) 1984-06-05 US disclosed