SCHEMBL890218

SCHEMBL890218

Cc1csc(-c2ccc(C)s2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 3/20 0.50
MAPT P10636 2/20 0.50
GFER P55789 1/20 0.50
PDE10A Q9Y233 1/20 0.46
CYP3A4 P08684 2/20 0.44
CYP2E1 P05181 1/20 0.44
CYP2A6 P11509 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2B6 P20813 1/20 0.44
KDM4E B2RXH2 2/20 0.41
TP53 P04637 2/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
NOS1 P29475 1/20 0.40
PLAU P00749 1/20 0.40

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
SCHEMBL299865 0.82 KDM4E (0.45) NPC1ALDH1A1HSD17B10MAPTPDE10A
SCHEMBL28560875 0.80 ALDH1A1 (0.47) NPC1ALDH1A1HSD17B10MAPTGFER
SCHEMBL10147188 0.80 PDE10A (0.40) NPC1ALDH1A1HSD17B10MAPTGFER
SCHEMBL289627 0.78 KDM4E (0.50) NPC1ALDH1A1MAPTPDE10ACYP3A4
SCHEMBL10141714 0.77 ALDH1A1 (0.48) NPC1ALDH1A1HSD17B10MAPTGFER
SCHEMBL890248 0.77 ALDH1A1 (0.44) NPC1ALDH1A1HSD17B10MAPTGFER
SCHEMBL18948971 0.77 NPC1 (0.44) NPC1ALDH1A1HSD17B10MAPTGFER
SCHEMBL13680730 0.77 LMNA (0.49) NPC1ALDH1A1MAPTPDE10ACYP3A4
SCHEMBL18157874 0.77 SMN1; SMN2 (0.55) NPC1ALDH1A1HSD17B10MAPTPDE10A
SCHEMBL5760540 0.76 GFER (0.51) NPC1ALDH1A1HSD17B10MAPTGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9156818-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-10-13 US disclosed
US-8933110-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-01-13 US disclosed
US-8927709-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2015-01-06 US disclosed
US-8822700-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-09-02 US disclosed
US-8815928-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-08-26 US disclosed
US-8785487-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-07-22 US disclosed
US-8653070-B2 Hepatitis C virus inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2014-02-18 US disclosed
US-20120076755-A1 Hepatitis C Virus Inhibitors ENANTA PHARMACEUTICALS, INC. 2012-03-29 US disclosed
US-20110142798-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-06-16 US disclosed
US-20110064695-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 US disclosed
US-20110064698-A1 HEPATITIS C VIRUS INHIBITORS ENANTA PHARMACEUTICALS, INC. 2011-03-17 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 (4 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-20110142798-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, SLC10A1, EIF2AK2 NPC1 36/4885ALDH1A1 365/4885HSD17B10 581/4885
US-20110064698-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 NPC1 34/4885ALDH1A1 354/4885HSD17B10 643/4885
US-20110064695-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, EIF2AK2, SLC10A1 NPC1 34/4885ALDH1A1 354/4885HSD17B10 643/4885
US-20120076755-A1 Hepatitis C Virus Inhibitors NSUN2, HCCS, HAVCR2 NPC1 411/4885ALDH1A1 984/4885HSD17B10 1498/4885

“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.