SCHEMBL1960665

SCHEMBL1960665

Fc1cccc(F)c1-c1nc2ccn(Cc3ccc(Cl)c(Cl)c3)cc-2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
CCR2 P41597 3/20 0.41
PHF8 Q9UPP1 1/20 0.41
KCNH2 Q12809 3/20 0.36
NR1I3 Q14994 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 2/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
POLB P06746 1/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL13548657 0.87 KCNH2 (0.48) SMN1; SMN2NPC1LMNAHTTRAB9A
SCHEMBL1963287 0.86 RAB9A (0.42) NPC1LMNARAB9AKCNH2POLB
SCHEMBL1961657 0.84 KCNH2 (0.41) NPC1LMNARAB9APHF8KCNH2
SCHEMBL1960189 0.81 NPC1 (0.47) SMN1; SMN2NPC1LMNAHTTRAB9A
SCHEMBL13463483 0.80 EIF4E (0.40) SMN1; SMN2NPC1LMNAHTTRAB9A
SCHEMBL1958831 0.79 KCNH2 (0.40) KCNH2TSHRPOLBKDM4E
SCHEMBL1958372 0.79 KMT2A (0.42) SMN1; SMN2NPC1LMNAHTTRAB9A
SCHEMBL1959935 0.77 KCNH2 (0.39) KCNH2
SCHEMBL13463708 0.77 KCNH2 (0.48) SMN1; SMN2NPC1LMNAHTTRAB9A
SCHEMBL13463880 0.76 KCNH2 (0.48) KCNH2FLT1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8779141-B2 Viral inhibitors GILEAD SCIENCES, INC. (US) 2014-07-15 US disclosed
EP-1521754-B1 VIRAL INHIBITORS LEUVEN K U RES & DEV (BE) 2011-08-31 EP disclosed
EP-2332938-A1 Viral inhibitors K.U. LEUVEN RESEARCH & DEVELOPMENT (BE) 2011-06-15 EP disclosed
US-7737162-B2 Viral inhibitors GILEAD SCIENCES, INC. (US) 2010-06-15 US disclosed
US-20100004281-A1 VIRAL INHIBITORS GILEAD SCIENCES, INC. 2010-01-07 US disclosed
US-20050239821-A1 Viral inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2005-10-27 US disclosed
EP-1521754-A2 VIRAL INHIBITORS K.U.Leuven Research & Development (BE) 2005-04-13 EP disclosed
WO-2004005286-A2 VIRAL INHIBITORS K.U.LEUVEN RESEARCH & DEVELOPMENT (BE) 2004-01-15 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-20100004281-A1 VIRAL INHIBITORS ZC3HAV1, MAVS, HAVCR2 SMN1; SMN2 3179/4885NPC1 607/4885LMNA 1843/4885
US-20050239821-A1 Viral inhibitors ZC3HAV1, ZC3HAV1L, ACE SMN1; SMN2 3260/4885NPC1 562/4885LMNA 1621/4885

“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.