SCHEMBL2214207

SCHEMBL2214207

Nc1ccc(Nc2nc(-c3ccc(-c4ccc(F)cc4)cc3)cc3ccnn23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALCA P06881 2/20 0.46
GPR119 Q8TDV5 1/20 0.46
CCNE1 P24864 1/20 0.38
CDK2 P24941 1/20 0.38
MAPK10 P53779 2/20 0.37
MAPK14 Q16539 2/20 0.37
CSNK2A1 P68400 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
TXN P10599 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 4/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GLA P06280 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
SCHEMBL2881842 0.85 GAK (0.46) CALCAGPR119CCNE1CDK2MAPK10
SCHEMBL2876734 0.81 BCDIN3D (0.42) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2881795 0.79 PLK1 (0.44) CSNK2A1RAB9AMEN1KMT2AMAPT
SCHEMBL2213844 0.79 PTPN1 (0.43) MAPK14NPC1RAB9AMEN1KMT2A
SCHEMBL2213436 0.78 CYP17A1 (0.43) RAB9AMAP4K4
SCHEMBL2215297 0.78 PTPN1 (0.45) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2216196 0.73 PRMT1 (0.45) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL2879548 0.73 KDR (0.43) CCNE1CDK2MAPK10NPC1RAB9A
SCHEMBL2213856 0.72 MELK (0.48) NPC1RAB9AMAPTSMN1; SMN2TP53
SCHEMBL2213308 0.71 MPL (0.43) CSNK2A1NPC1RAB9AMEN1KMT2A

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-1797096-B1 PYRAZOLOPYRIMIDINES AS INHIBITORS OF PROTEIN KINASE B (AKT) BAYER SCHERING PHARMA AG (DE) 2011-07-27 EP disclosed
US-7745446-B2 Pyrazolo[1,5-c]pyrimidines BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-06-29 US disclosed
US-20070254046-A1 Novel Pyrazolopyrimidines ALTANA PHARMA AG (DE) 2007-11-01 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-20070254046-A1 Novel Pyrazolopyrimidines MCL1, RARS2, CDK4 CALCA 4217/4885GPR119 1181/4885CCNE1 13/4885

“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.