SCHEMBL3621482

SCHEMBL3621482

Cc1cnc(Nc2cccc(-n3ccnc3)c2)nc1-c1cccc2[nH]ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.48
PDGFRB P09619 1/20 0.48
BCR P11274 1/20 0.48
SRC P12931 1/20 0.48
PDGFRA P16234 1/20 0.48
PRKCA P17252 1/20 0.48
PRKCD Q05655 1/20 0.48
CDK1 P06493 3/20 0.45
KDR P35968 1/20 0.45
JAK2 O60674 2/20 0.45
JAK1 P23458 1/20 0.45
CDK7 P50613 3/20 0.41
CCNH P51946 3/20 0.41
JAK3 P52333 1/20 0.40
SYK P43405 3/20 0.39
CDK9 P50750 6/20 0.39
BRD4 O60885 1/20 0.39
CCNT1 O60563 5/20 0.39
CCNA2 P20248 5/20 0.39
CDK2 P24941 5/20 0.39

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
SCHEMBL3617951 0.80 CDK1 (0.54) CDK1KDRJAK2JAK1CDK7
SCHEMBL3620720 0.78 JAK1 (0.49) CDK1KDRJAK2JAK1CDK7
SCHEMBL3607870 0.77 JAK1 (0.50) ABL1PDGFRBCDK1KDRJAK2
SCHEMBL3620405 0.77 CDK1 (0.55) ABL1SRCPRKCDCDK1KDR
SCHEMBL3618079 0.76 SYK (0.49) CDK1KDRJAK2JAK1CDK7
SCHEMBL3619953 0.75 KDR (0.47) PDGFRBPDGFRACDK1KDRJAK2
SCHEMBL3615782 0.71 CDK1 (0.49) ABL1SRCPRKCDCDK1KDR
SCHEMBL8592858 0.71 ABL1 (0.67) ABL1PDGFRBBCRSRCPDGFRA
SCHEMBL3622052 0.70 CDK2 (0.54) ABL1SRCPRKCDCDK1KDR
SCHEMBL7124250 0.69 ABL1 (0.48) ABL1PDGFRBBCRSRCPDGFRA

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-20100093776-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-04-15 US disclosed
US-20100093776-A1 Organic Compounds and Their Uses NOVARTIS AG 2010-04-15 US disclosed
WO-2008079918-A1 INDOL-4-YL-PYRIMIDINYL-2-YL-AMINE DERIVATIVES AND USE THEREOF AS CYCLIN DEPENDANT KINASE INHIBITORS NOVARTIS AG (CH) 2008-07-03 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-20100093776-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 ABL1 3215/4885PDGFRB 4797/4885BCR 3115/4885

“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.