SCHEMBL12374701

SCHEMBL12374701

COCCNC(=O)c1cccc(/C=C/C(=O)c2c(C)c(C)c(C)n(C)c2=O)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
HPGD P15428 6/20 0.40
KDM4E B2RXH2 3/20 0.38
HSD17B10 Q99714 3/20 0.38
HTT P42858 1/20 0.38
GLA P06280 1/20 0.38
THRB P10828 1/20 0.37
CYP1A2 P05177 3/20 0.36
CYP2C19 P33261 3/20 0.36
RAB9A P51151 3/20 0.36
CYP2C9 P11712 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 1/20 0.34
ADORA2A P29274 1/20 0.34

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
SCHEMBL4520097 0.80 PADI4 (0.40) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL4520101 0.80 PADI4 (0.40) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL13818103 0.79 PADI4 (0.40) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL13403294 0.77 MEN1 (0.51) ALDH1A1HPGDKDM4EHTTCYP1A2
SCHEMBL2277602 0.77 LMNA (0.40) ALDH1A1HPGDKDM4EHTTGLA
SCHEMBL2277607 0.77 LMNA (0.40) ALDH1A1HPGDKDM4EHTTGLA
SCHEMBL13403305 0.73 KDM4E (0.50) ALDH1A1HPGDKDM4EHSD17B10HTT
SCHEMBL12374855 0.73 MEN1 (0.48) ALDH1A1HPGDKDM4ERAB9AMEN1
SCHEMBL13818097 0.72 PADI4 (0.40) ALDH1A1HPGDKDM4ECYP1A2CYP2C19
SCHEMBL2281362 0.72 HPGD (0.57) ALDH1A1HPGDKDM4EHSD17B10GLA

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-7989478-B2 decreases expression of a Type I collage gene in a tissue to induce a reduction in accumulation of collagen and thereby improves tissue fibrosis SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-02 US disclosed