SCHEMBL9979029

SCHEMBL9979029

CCCc1ccc(NC(=O)c2cc(C(=O)Nc3ccc(CCC)cc3C)cc(C(=O)Nc3ccc(CCC)cc3C)c2)c(C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.52
GPR174 Q9BXC1 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2C9 P11712 1/20 0.47
PLK1 P53350 5/20 0.46
P2RY14 Q15391 1/20 0.46
PLK3 Q9H4B4 1/20 0.45
TAS1R3 Q7RTX0 2/20 0.45
TAS1R1 Q7RTX1 2/20 0.45
TAS1R2 Q8TE23 2/20 0.45
GFER P55789 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL9979434 0.91 PLK1 (0.52) NR1H4GPR174PLK1PLK3MEN1
SCHEMBL9979180 0.87 NR1H4 (0.55) NR1H4GPR174ALDH1A1MAPTLMNA
SCHEMBL9979115 0.80 NR1H4 (0.51) NR1H4GPR174ALDH1A1MAPTLMNA
SCHEMBL13181139 0.78 HDAC1 (0.59) ALDH1A1MAPTCYP1A2CYP2C19CYP2C9
SCHEMBL9978841 0.77 TRPV1 (0.58) NR1H4ALDH1A1LMNAPLK1POLB
SCHEMBL1696350 0.77 POLB (0.60) ALDH1A1MAPTLMNAHTTCYP1A2
SCHEMBL4449040 0.76 TAS1R3 (0.69) ALDH1A1MAPTHTTCYP1A2CYP2C19
SCHEMBL23665648 0.76 SKP2 (0.40) NR1H4GPR174ALDH1A1MAPTCYP1A2
SCHEMBL9978920 0.76 MEN1 (0.44) GPR174ALDH1A1MAPTLMNAHTT
SCHEMBL9979256 0.76 MEN1 (0.44) ALDH1A1MAPTLMNAHTTCYP1A2

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-8492468-B2 Polypropylene resin composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-23 US disclosed
US-20110301268-A1 POLYPROPYLENE RESIN COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-08 US disclosed