SCHEMBL6204466

SCHEMBL6204466

COC([O])c1cc(Cl)ccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
ALDH1A1 P00352 5/20 0.35
TDP1 Q9NUW8 3/20 0.35
TSHR P16473 2/20 0.35
CYP3A4 P08684 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TRPV4 Q9HBA0 1/20 0.34
ABL1 P00519 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32

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
SCHEMBL6203039 0.84 TP53 (0.52) TP53LMNAHTTALDH1A1TDP1
SCHEMBL27606183 0.82 CYP3A4 (0.41) TP53LMNAHTTALDH1A1TDP1
SCHEMBL16950473 0.78 TP53 (0.41) TP53LMNAHTTALDH1A1TDP1
SCHEMBL6204469 0.76 ALDH1A1 (0.40) TP53LMNAHTTALDH1A1TDP1
SCHEMBL6204061 0.75 TSHR (0.41) LMNATDP1TSHRCYP3A4MAPT
SCHEMBL16054236 0.75 TSHR (0.41) LMNATDP1TSHRCYP3A4MAPT
SCHEMBL9366066 0.74 ALDH1A1 (0.43) TP53LMNAHTTALDH1A1TDP1
SCHEMBL10980265 0.72 TP53 (0.47) TP53LMNAHTTALDH1A1TDP1
SCHEMBL20280271 0.72 TP53 (0.42) TP53LMNAHTTALDH1A1TDP1
SCHEMBL10612899 0.72 TP53 (0.50) TP53LMNAHTTALDH1A1TDP1

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
EP-1506175-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-16 EP disclosed
WO-2003097609-A1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDFG RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2003-11-27 WO disclosed