SCHEMBL1001747

SCHEMBL1001747

CC(C)(C)[Si](C)(C)OCCN(C#N)c1ccc(C2=NOC(CNC(=O)c3ccc(Cl)s3)C2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.40
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MIF P14174 1/20 0.35
MAPK1 P28482 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
SCHEMBL12926680 0.87 F10 (0.45) F10NPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL1004839 0.83 F10 (0.44) F10NPC1RAB9ASMN1; SMN2MIF
SCHEMBL1023288 0.81 F10 (0.65) F10
SCHEMBL1095841 0.78 F10 (0.46) F10NPC1RAB9ASMN1; SMN2
SCHEMBL1096774 0.78 F10 (0.48) F10NPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL1101328 0.77 F10 (0.46) F10NPC1RAB9ASMN1; SMN2MIF
SCHEMBL1096474 0.77 NPC1 (0.52) F10NPC1RAB9A
SCHEMBL1023752 0.77 F10 (0.63) F10
SCHEMBL1095884 0.77 F10 (0.47) F10NPC1RAB9ASMN1; SMN2MAPK1
SCHEMBL10313036 0.77 F10 (0.45) F10NPC1RAB9ASMN1; SMN2MIF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015241-A1 SUBSTITUTED HETEROCYCLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-01-20 US disclosed
US-20110015241-A1 SUBSTITUTED HETEROCYCLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-01-20 US 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-20110015241-A1 SUBSTITUTED HETEROCYCLES AND USE THEREOF F2, VKORC1, HMBS F10 104/4885NPC1 1664/4885RAB9A 3266/4885

“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.