SCHEMBL2819282

SCHEMBL2819282

FC(F)(F)c1ccc(Nc2nccc(-c3ccccn3)n2)nc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SYK P43405 8/20 0.47
METAP1 P53582 1/20 0.46
NPY5R Q15761 1/20 0.45
TRPV1 Q8NER1 4/20 0.45
MAPK3 P27361 1/20 0.45
CCR6 P51684 1/20 0.43
ABL1 P00519 1/20 0.43
BCR P11274 1/20 0.43
PRKCA P17252 1/20 0.43
CTSC P53634 1/20 0.42
CDK1 P06493 1/20 0.42
CDK4 P11802 1/20 0.42
CCNB1 P14635 1/20 0.42
CCNA2 P20248 1/20 0.42
CCND1 P24385 1/20 0.42
CDK2 P24941 1/20 0.42
CCNA1 P78396 1/20 0.42

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
SCHEMBL2819228 0.80 CDK4 (0.54) SYKMETAP1ABL1BCRPRKCA
SCHEMBL2824218 0.80 SLC2A1 (0.61) SYKABL1BCRPRKCACDK1
SCHEMBL2827747 0.79 ABL1 (0.47) NPC1RAB9ASYKABL1BCR
SCHEMBL4476417 0.79 KMT2A (0.54) NPC1RAB9AMETAP1NPY5RTRPV1
SCHEMBL6368472 0.78 NPY5R (0.72) NPC1RAB9ANPY5R
SCHEMBL30745709 0.78 NPY5R (0.72) NPC1RAB9ANPY5R
SCHEMBL5732656 0.77 AURKA (0.66) SYKABL1BCRPRKCACDK4
SCHEMBL15534348 0.76 MEN1 (0.46) NPC1RAB9ASYKTRPV1CTSC
SCHEMBL22599687 0.74 METAP1 (0.48) NPC1RAB9AMETAP1NPY5RTRPV1
SCHEMBL30000742 0.74 METAP1 (0.48) NPC1RAB9AMETAP1NPY5RTRPV1

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
EP-1742634-B1 POLYCYCLIC PYRIMIDINES AS POTASSIUM ION CHANNEL MODULATORS ICAGEN INC (US) 2010-10-27 EP disclosed
US-7560464-B2 Polycyclic pyrimidines as potassium ion channel modulators ICAGEN, INC. (US) 2009-07-14 US disclosed
US-20050267089-A1 Polycyclic pyrimidines as potassium ion channel modulators ICAGEN, INC. (US) 2005-12-01 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-20050267089-A1 Polycyclic pyrimidines as potassium ion channel modulators KCNJ2, KCNJ1, KCNJ11 NPC1 1559/4885RAB9A 3914/4885SYK 4419/4885

“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.