SCHEMBL10120792

SCHEMBL10120792

CC(C)COCCC[C@H](C)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL12031279 0.82 LMNA (0.39) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL3962044 0.79 SPHK1 (0.38) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL11858528 0.79 SPHK1 (0.42) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL25726088 0.78 LMNA (0.36) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL12437244 0.78 ALDH1A1 (0.36)
SCHEMBL26719977 0.78 SPHK1 (0.37) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL16248567 0.78 LMNA (0.36) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL25726084 0.78 LMNA (0.36) SPHK2SPHK1CYP3A4HSD17B10
SCHEMBL19245588 0.77
SCHEMBL31086433 0.76 SPHK1 (0.44) SPHK2SPHK1HSD17B10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9676802-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2017-06-13 US disclosed
US-8933110-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-01-13 US disclosed
US-20140308243-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2014-10-16 US disclosed
US-8785487-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-07-22 US disclosed
US-20120076755-A1 Hepatitis C Virus Inhibitors ENANTA PHARMACEUTICALS, INC. 2012-03-29 US disclosed
US-20120076755-A1 Hepatitis C Virus Inhibitors ENANTA PHARMACEUTICALS, INC. 2012-03-29 US disclosed
US-20110189129-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-08-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140308243-A1 HEPATITIS C VIRUS INHIBITORS ZC3HAV1, ZC3HAV1L, HAVCR2 SPHK2 3124/4885SPHK1 2944/4885CYP3A4 428/4885
US-20110189129-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, HCCS, NSUN2 SPHK2 3335/4885SPHK1 3134/4885CYP3A4 737/4885
US-20120076755-A1 Hepatitis C Virus Inhibitors NSUN2, HCCS, HAVCR2 SPHK2 3158/4885SPHK1 2989/4885CYP3A4 800/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.