SCHEMBL15701019

SCHEMBL15701019

CCOC(=O)Cn1ccc(NC(=O)c2cscn2)cc1=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 9/20 0.47
CYP2C8 P10632 6/20 0.47
GRM1 Q13255 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.42
MAP3K5 Q99683 1/20 0.42
GRM4 Q14833 2/20 0.41
FPR2 P25090 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 1/20 0.38
MAPT P10636 1/20 0.38
PARP1 P09874 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
SCHEMBL15701030 0.85 GRM1 (0.47) CYP2C9CYP2C8GRM1CYP3A4CYP2D6
SCHEMBL17147286 0.77 CYP2C9 (0.52) CYP2C9CYP2C8GRM1CYP3A4CYP2D6
SCHEMBL15701047 0.76 CYP2C9 (0.52) CYP2C9CYP2C8GRM1CYP3A4CYP2D6
SCHEMBL15701011 0.75 CYP2C9 (0.59) CYP2C9CYP2C8CYP3A4CYP2D6HPGD
SCHEMBL15701276 0.74 MAPT (0.55) MAP3K5GRM4NPC1RAB9ASMN1; SMN2
SCHEMBL15701048 0.73 CYP2C9 (0.53) CYP2C9CYP2C8GRM1CYP3A4CYP2D6
SCHEMBL15701053 0.72 MAPT (0.44) CYP2C9CYP3A4MAP3K5GRM4NPC1
SCHEMBL15701050 0.71 CYP2C9 (0.61) CYP2C9CYP2C8CYP3A4CYP2D6NPC1
SCHEMBL2828598 0.70 ALDH1A1 (0.49) RAB9ASMN1; SMN2MAPT
SCHEMBL18913971 0.69 GSK3A (0.46) RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2914592-B1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INT (DE) 2017-10-11 EP disclosed
US-9334249-B2 Inhibitors of cytomegalovirus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-10 US disclosed
US-9334249-B2 Inhibitors of cytomegalovirus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-10 US disclosed
US-20150284348-A1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-08 US disclosed
US-20150284348-A1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-08 US disclosed
WO-2014070979-A1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-05-08 WO 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 (1 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-20150284348-A1 INHIBITORS OF CYTOMEGALOVIRUS CDKN1A, CCNA1, IFNAR1 CYP2C9 2373/4885CYP2C8 2028/4885GRM1 2624/4885

“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.