SCHEMBL15701286

SCHEMBL15701286

CC(C(=O)Nc1nc2ccc(NC(=O)c3cscn3)cc2[nH]1)c1cccc(C#N)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.44
PSEN2 P49810 3/20 0.44
APH1B Q8WW43 3/20 0.44
NCSTN Q92542 3/20 0.44
APH1A Q96BI3 3/20 0.44
PSENEN Q9NZ42 3/20 0.44
IRAK4 Q9NWZ3 1/20 0.42
ABL1 P00519 1/20 0.42
GRM4 Q14833 1/20 0.41
GRM1 Q13255 1/20 0.40
CYP2C9 P11712 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MLLT1 Q03111 1/20 0.38
CSNK1A1 P48729 1/20 0.37
CSNK1D P48730 1/20 0.37
GSK3B P49841 1/20 0.37
CSNK1G2 P78368 1/20 0.37
CYP2C8 P10632 2/20 0.37
XIAP P98170 1/20 0.37
NR2E3 Q9Y5X4 1/20 0.37

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
SCHEMBL15701291 1.00 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15701107 1.00 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL15701109 0.89 GRM1 (0.43) IRAK4GRM4GRM1CYP2C9SMN1; SMN2
SCHEMBL15701105 0.89 GRM1 (0.43) IRAK4GRM4GRM1CYP2C9SMN1; SMN2
SCHEMBL15701279 0.89 GRM1 (0.43) IRAK4GRM4GRM1CYP2C9SMN1; SMN2
SCHEMBL15701290 0.86 CYP2C9 (0.53) CYP2C9CSNK1DCYP2C8RAF1BRAF
SCHEMBL15701082 0.86 CYP2C9 (0.53) CYP2C9CSNK1DCYP2C8RAF1BRAF
SCHEMBL15701292 0.86 CYP2C9 (0.53) CYP2C9CSNK1DCYP2C8RAF1BRAF
SCHEMBL15701145 0.82 PSEN1 (0.46) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL19446744 0.80 CYP2C9 (0.53) CYP2C9CSNK1DCYP2C8BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 PSEN1 296/4885PSEN2 899/4885APH1B 416/4885

“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.