SCHEMBL11662035

SCHEMBL11662035

C=CCc1c(OC(=O)CC)ccc2c1C(=O)NC2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 3/20 0.39
▸ ALOX15 P16050 1/20 0.35
▸ ACHE P22303 1/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ HPGD P15428 4/20 0.33
▸ KDM4E B2RXH2 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ GAA P10253 3/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ TSHR P16473 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ VCP P55072 1/20 0.32
▸ ALOX5 P09917 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
SCHEMBL28326979 0.74 ALDH1A1 (0.47) ACHEHPGDKDM4EKMT2AALDH1A1
SCHEMBL11615863 0.74 SRD5A1 (0.44) SRD5A1HPGDKDM4EKMT2AALDH1A1
SCHEMBL10582955 0.72 PARP1 (0.37) SRD5A1HPGDKDM4EALDH1A1GAA
SCHEMBL4975643 0.71 PARP1 (0.39) KMT2AALDH1A1L3MBTL1CASP3MEN1
SCHEMBL2312949 0.71 PARP1 (0.39) HPGDALDH1A1L3MBTL1CASP3
SCHEMBL27751172 0.70 GSK3B (0.38) HPGDKDM4EALDH1A1GAAHSD17B10
SCHEMBL19667897 0.70 CYP4F2 (0.40) SRD5A1HPGDKDM4EALDH1A1GAA
SCHEMBL28247877 0.70 KMT2A (0.45) SRD5A1ALOX15ACHEFGFR1HPGD
SCHEMBL28258198 0.68 KMT2A (0.40) SRD5A1ALOX15ACHEFGFR1HPGD
SCHEMBL11662037 0.67 KDM4E (0.39) HPGDKDM4EKMT2AALDH1A1GAA

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-4106940-A N-ALKYLPHTHALIMIDE DERIVATIVE OIL FORMER AGFA-GEVAERT, A.G. (DE) 1978-08-15 — — US disclosed
Send feedback