SCHEMBL2584959

SCHEMBL2584959

Cc1cc(C)c(N=NNc2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 15/20 0.48
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 1/20 0.36
FFAR4 Q5NUL3 2/20 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
SCHEMBL2586606 1.00 RAPGEF4 (0.48) RAPGEF4NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL12915426 1.00 RAPGEF4 (0.48) RAPGEF4NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL3286343 0.77 MEN1 (0.48) RAPGEF4NPC1MAPTRAB9AALDH1A1
SCHEMBL3286340 0.77 MEN1 (0.48) RAPGEF4NPC1MAPTRAB9AALDH1A1
SCHEMBL1755254 0.74 RAPGEF4 (0.50) RAPGEF4NPC1MAPTRAB9ASMN1; SMN2
SCHEMBL27621238 0.69 F2 (0.38) RAPGEF4MAPTALDH1A1
SCHEMBL3933025 0.67 MEN1 (0.68) RAPGEF4NPC1MAPTRAB9AALDH1A1
SCHEMBL1405485 0.67 MEN1 (0.68) RAPGEF4NPC1MAPTRAB9AALDH1A1
SCHEMBL502929 0.66 RAPGEF4 (1.00) RAPGEF4
SCHEMBL502928 0.66 RAPGEF4 (0.43) RAPGEF4MAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9403781-B2 Crystalline 1H-1,2,3-triazol-5-ylidenes THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-08-02 US disclosed
US-20130197178-A1 CRYSTALLINE 1H-1,2,3-TRIAZOL-5-YLIDENES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-08-01 US disclosed
WO-2011139704-A2 CRYSTALLINE 1H-1,2,3-TRIAZOL-5-YLIDENES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-11-10 WO disclosed
US-20060094591-A1 Polymerisation catalysts INNOVENE EUROPE LTD. (GB) 2006-05-04 US disclosed
EP-1583778-A2 POLYMERISATION CATALYSTS WITH TRIAZENIDO LIGANDS Innovene Europe Limited (GB) 2005-10-12 EP disclosed
WO-2004063233-A2 POLYMERISATION CATALYSTS WITH TRIAZENIDO LIGANDS INNOVENE EUROPE LIMITED (GB) 2004-07-29 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-20060094591-A1 Polymerisation catalysts NOD2, TELO2, MUS81 RAPGEF4 3861/4885NPC1 3789/4885MAPT 3440/4885
US-20130197178-A1 CRYSTALLINE 1H-1,2,3-TRIAZOL-5-YLIDENES TCP1, CCT3, CCT2 RAPGEF4 3048/4885NPC1 987/4885MAPT 1491/4885

“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.