SCHEMBL4700667

SCHEMBL4700667

Cc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1N

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.56
LMNA P02545 1/20 0.56
RAB9A P51151 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
BRAF P15056 10/20 0.56
RAF1 P04049 10/20 0.56

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
SCHEMBL29878393 1.00 NPC1 (0.56) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL4241513 0.90 HDAC4 (0.54) BRAFRAF1
SCHEMBL26165525 0.89 RAB9A (0.60) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL30017275 0.85 NPC1 (0.56) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL21624459 0.85 NPC1 (0.56) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL23482203 0.85 NPC1 (0.56) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL30405369 0.85 NPC1 (0.56) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL29071543 0.84 RAF1 (0.57) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL26075563 0.84 LMNA (0.62) NPC1LMNARAB9ASMN1; SMN2BRAF
SCHEMBL29877984 0.84 RAF1 (0.58) NPC1LMNARAB9ASMN1; SMN2BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080275054-A1 3-(Substituted Amino)-Pyrazolo[3, 4-D]Pyrimidines as Ephb and Vegfr2 Kinase Inhibitors HOLZER PHILIPP 2008-11-06 US disclosed
EP-1963327-A1 3-(SUBSTITUTED AMINO)-PYRAZOLO[3,4-d]PYRIMIDINES AS EPHB AND VEGFR2 KINASE INHIBITORS Novartis AG (CH) 2008-09-03 EP disclosed
WO-2007062805-A1 3-(SUBSTITUTED AMINO)-PYRAZOLO[3,4-d]PYRIMIDINES AS EPHB AND VEGFR2 KINASE INHIBITORS NOVARTIS AG (CH) 2007-06-07 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-20080275054-A1 3-(Substituted Amino)-Pyrazolo[3, 4-D]Pyrimidines as Ephb and Vegfr2 Kinase Inhibitors EPHB3, EPHB2, EPHB1 NPC1 4064/4885LMNA 4752/4885RAB9A 2817/4885

“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.