SCHEMBL18240602

SCHEMBL18240602

C/C(=C\C(c1ccc(C)cc1)c1cccc(C)c1)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.41
LMNA P02545 5/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
KEAP1 Q14145 3/20 0.35
NFE2L2 Q16236 3/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
AKR1C3 P42330 2/20 0.35
AKR1C2 P52895 1/20 0.35
ACHE P22303 1/20 0.34
GAA P10253 1/20 0.34
STAT3 P40763 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
SCHEMBL18240604 1.00 ACP3 (0.41) ACP3LMNASMN1; SMN2KEAP1NFE2L2
SCHEMBL18240605 1.00 ACP3 (0.41) ACP3LMNASMN1; SMN2KEAP1NFE2L2
SCHEMBL18240631 0.94 ACP3 (0.45) ACP3LMNASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL18240628 0.94 ACP3 (0.45) ACP3LMNASMN1; SMN2HSD17B10ALDH1A1
SCHEMBL18240657 0.89 LMNA (0.46) LMNASMN1; SMN2KEAP1NFE2L2ALDH1A1
SCHEMBL18240656 0.89 LMNA (0.46) LMNASMN1; SMN2KEAP1NFE2L2ALDH1A1
SCHEMBL18240669 0.89 TRPM8 (0.43) ACP3LMNAALDH1A1
SCHEMBL18240667 0.89 TRPM8 (0.43) ACP3LMNAALDH1A1
SCHEMBL18240664 0.88 GAA (0.41) ACP3LMNASMN1; SMN2ALDH1A1TP53
SCHEMBL18240659 0.88 ALDH1A1 (0.39) ACP3LMNASMN1; SMN2ALDH1A1TP53

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
EP-2906970-B1 HIGH REFRACTIVE INDEX OPHTHALMIC DEVICE MATERIALS WITH REDUCED TACK NOVARTIS AG (CH) 2016-11-23 EP claimed