SCHEMBL1226418

SCHEMBL1226418

CCCC(C(=O)OC)c1c(C)nc(Cl)nc1Cl

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PSIP1 O75475 2/20 0.31
CYP2C9 P11712 1/20 0.31
NPR3 P17342 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL1227701 0.84 PSIP1 (0.40) PSIP1
SCHEMBL1227073 0.80 PSIP1 (0.41) PSIP1
SCHEMBL1227685 0.80 ADORA3 (0.43) PSIP1CYP2C9CYP2C19KDM4ELMNA
SCHEMBL1226437 0.80 KDM4E (0.46) L3MBTL1PSIP1KDM4ELMNA
SCHEMBL1227124 0.79 MAPK1 (0.44) KDM4ELMNA
SCHEMBL1227845 0.72 MAPK1 (0.45) KDM4ELMNA
SCHEMBL2041516 0.71 PDE4A (0.36) PSIP1
SCHEMBL2042924 0.71 PSIP1 (0.31) PSIP1
SCHEMBL6122795 0.69 PSIP1 (0.57) L3MBTL1PSIP1CYP2C9CYP2C19
SCHEMBL2039818 0.69 PSIP1 (0.34) PSIP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150051195-A1 NOVEL VIRAL REPLICATION INHIBITORS CISTIM LEUVEN VZW (BE) 2015-02-19 US disclosed
US-8906906-B2 Viral replication inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2014-12-09 US disclosed
EP-2462122-A1 NOVEL VIRAL REPLICATION INHIBITORS Katholieke Universiteit Leuven (BE) 2012-06-13 EP disclosed
US-20120129840-A1 NOVEL VIRAL REPLICATION INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2012-05-24 US disclosed
WO-2011015641-A1 NOVEL VIRAL REPLICATION INHIBITORS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2011-02-10 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 (2 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-20120129840-A1 NOVEL VIRAL REPLICATION INHIBITORS MAVS, EIF2AK2, SAMHD1 CA1 4876/4885CA2 4597/4885TAS1R3 4548/4885
US-20150051195-A1 NOVEL VIRAL REPLICATION INHIBITORS MAVS, EIF2AK2, SAMHD1 CA1 4876/4885CA2 4597/4885TAS1R3 4548/4885

“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.