SCHEMBL10095487

SCHEMBL10095487

CCCOC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2CC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 6/20 0.40
MAPT P10636 6/20 0.40
MTNR1B P49286 2/20 0.40
GAA P10253 2/20 0.40
TSHR P16473 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MTNR1A P48039 1/20 0.40
NPC1 O15118 3/20 0.40
MAPK1 P28482 3/20 0.40
HTT P42858 3/20 0.40
RAB9A P51151 3/20 0.39
KDM4E B2RXH2 5/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HCRTR1 O43613 1/20 0.39
GRIK2 Q13002 1/20 0.39
TP53 P04637 1/20 0.38

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
SCHEMBL10095486 0.96 HPGD (0.45) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095485 0.94 NPC1 (0.41) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095490 0.93 MAPT (0.40) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095685 0.93 GRIK2 (0.45) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL981888 0.93 MAPK1 (0.48) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095532 0.92 MAPT (0.42) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095535 0.92 MEN1 (0.42) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095489 0.92 LMNA (0.39) HPGDSMN1; SMN2LMNAMAPTMTNR1B
SCHEMBL10095757 0.91 HPGD (0.41) HPGDSMN1; SMN2LMNAMAPTGAA
SCHEMBL10095536 0.91 MTNR1B (0.40) HPGDSMN1; SMN2LMNAMAPTMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-8927576-B2 HCV inhibitor and therapeutic agent combinations PTC Therpeutics, Inc. (US) 2015-01-06 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations PTC THERAPEUTICS, INC. (US) 2012-02-02 US disclosed
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
US-8013006-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-09-06 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
US-7868037-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-01-11 US disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 US disclosed
US-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus PTC THERAPEUTICS, INC. 2008-04-24 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-20080096928-A9 Indole compounds that modify translational control of Hepatitis C virus EIF2AK2, INMT, IDO1 HPGD 3067/4885SMN1; SMN2 4841/4885LMNA 4373/4885
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS HPGD 1033/4885SMN1; SMN2 4525/4885LMNA 3101/4885
US-20120027721-A1 HCV Inhibitor and Therapeutic Agent Combinations HAVCR2, SERPINB1, ENPEP HPGD 1854/4885SMN1; SMN2 4565/4885LMNA 4367/4885

“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.