SCHEMBL15701148

SCHEMBL15701148

CC(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1nc2cc(NC(=O)c3cscn3)ccc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 8/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C8 P10632 5/20 0.46
CYP2D6 P10635 1/20 0.46
RAF1 P04049 1/20 0.41
TEK Q02763 2/20 0.41
KDR P35968 1/20 0.40
MTOR P42345 1/20 0.39
NTRK1 P04629 1/20 0.39
NTRK2 Q16620 1/20 0.39
IDE P14735 1/20 0.38
MAPK1 P28482 1/20 0.38
MAPK10 P53779 1/20 0.38
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
BRAF P15056 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
SCHEMBL19446744 0.87 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C8CYP2D6TEK
SCHEMBL15701104 0.86 TEK (0.51) CYP2C9CYP3A4CYP2C8CYP2D6TEK
SCHEMBL15701083 0.85 CYP2C9 (0.49) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL15701147 0.83 CYP2C9 (0.51) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL15701025 0.82 CSNK1D (0.50) CYP2C9CYP3A4CYP2C8CYP2D6POLB
SCHEMBL15701082 0.80 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL15701290 0.80 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL15701292 0.80 CYP2C9 (0.53) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL17148441 0.77 CYP2C9 (0.44) CYP2C9CYP3A4CYP2C8CYP2D6RAF1
SCHEMBL17148372 0.76 FFAR2 (0.53) CYP2C9POLB

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 4 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-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 2373/4885CYP3A4 1215/4885CYP2C8 2028/4885

“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.