SCHEMBL15701088

SCHEMBL15701088

O=C(Cc1ccc(NC(=O)c2cscn2)cc1)NCc1cccc(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.52
CYP2C9 P11712 2/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
LMNA P02545 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 1/20 0.48
BACE1 P56817 1/20 0.48
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
PLA2G1B P04054 1/20 0.46
CYP1A2 P05177 1/20 0.46
GAA P10253 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
GLS O94925 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL15701095 0.91 MTOR (0.49) CYP3A4CYP2C9LMNAMAPTBACE1
SCHEMBL15701089 0.91 CNR1 (0.53) CYP3A4CYP2C9LMNAMEN1KMT2A
SCHEMBL15701122 0.86 ROCK1 (0.48) NPC1RAB9APOLBGLS
SCHEMBL15701136 0.82 CYP2C9 (0.53) CYP3A4CYP2C9LMNAMEN1KMT2A
SCHEMBL15701265 0.82 PSEN1 (0.50) CYP3A4CYP2C9LMNAMEN1KMT2A
SCHEMBL15701123 0.82 PTGDR2 (0.44) RAB9AMEN1KMT2AANO1
SCHEMBL15701108 0.81 PSEN1 (0.57) CYP3A4CYP2C9LMNAMEN1KMT2A
SCHEMBL15701050 0.81 CYP2C9 (0.61) CYP3A4CYP2C9NPC1RAB9AMEN1
SCHEMBL15701097 0.80 RIOK2 (0.56) CYP3A4CYP2C9LMNAMEN1KMT2A
SCHEMBL15701016 0.80 MEN1 (0.53) CYP3A4CYP2C9NPC1RAB9ALMNA

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 CYP3A4 1215/4885CYP2C9 2373/4885NPC1 504/4885

“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.