SCHEMBL14087550

SCHEMBL14087550

COc1ccc2c(c1)CCC1[C@@H]3C(CCCC(=O)NCc4ccccc4)CC(=O)[C@@]3(C)CC[C@H]21

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HSD17B1 P14061 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HRH3 Q9Y5N1 10/20 0.46
▸ CYP3A4 P08684 1/20 0.45
▸ KCNH2 Q12809 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ STS P08842 1/20 0.44
▸ ESR1 P03372 1/20 0.42

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
SCHEMBL217670 1.00 LMNA (0.49) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL217671 1.00 LMNA (0.49) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL218026 0.98 LMNA (0.48) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL218027 0.98 LMNA (0.48) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL218450 0.97 LMNA (0.47) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL218449 0.97 LMNA (0.47) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL217537 0.91 LMNA (0.46) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL217538 0.91 LMNA (0.46) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL2738634 0.91 LMNA (0.47) LMNAMAPTHSD17B1RECQLSMN1; SMN2
SCHEMBL218862 0.91 LMNA (0.49) LMNAMAPTHSD17B1RECQLSMN1; SMN2

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-1685150-B1 NOVEL 17beta HYDROXYSTEROID DEHYDROGENASE TYPE I INHIBITORS SOLVAY PHARM GMBH (DE) 2008-09-03 — — EP disclosed
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