SCHEMBL16701134

SCHEMBL16701134

Cc1ccnnc1-c1cnn(C)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AXL P30530 8/20 0.42
PIM1 P11309 2/20 0.40
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
TTK P33981 1/20 0.38
MAPK1 P28482 1/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
INCENP Q9NQS7 1/20 0.37
TPX2 Q9ULW0 1/20 0.37
MAPK14 Q16539 1/20 0.37
BRD4 O60885 1/20 0.36
ADORA2A P29274 1/20 0.36
DYRK1A Q13627 1/20 0.36
LRRK2 Q5S007 1/20 0.36
KDR P35968 1/20 0.36
EPHB4 P54760 1/20 0.36
TEK Q02763 1/20 0.36
NTRK1 P04629 1/20 0.36

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
SCHEMBL10094709 0.76 CYP2A6 (0.54) AXLPIM1CCNA2CDK2TTK
SCHEMBL17816457 0.74 PIM1 (0.41) AXLPIM1CCNA2CDK2TTK
SCHEMBL30123115 0.71 DYRK1A (0.46) AXLTTKMAPK1AURKAAURKB
SCHEMBL12503535 0.70 MAPT (0.46) PIM1MAPK1BRD4DYRK1AKDR
SCHEMBL16561261 0.70 JAK2 (0.44) AXLPIM1CCNA2CDK2TTK
SCHEMBL15220120 0.70 SLC22A12 (0.51) MAPK1AURKAAURKBINCENPTPX2
SCHEMBL16340781 0.69 COMT (0.46) MAPK1MAPK14BRD4LRRK2
SCHEMBL17816262 0.69 KDM5B (0.38) AXLPIM1CCNA2CDK2TTK
SCHEMBL28210973 0.68 CYP2A6 (0.62) LRRK2
SCHEMBL26242520 0.68 PIM1 (0.39) AXLPIM1TTKMAPK1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9440970-B2 Pyrazole derivative MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2016-09-13 US disclosed
US-20150133448-A1 NOVEL PYRAZOLE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2015-05-14 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-20150133448-A1 NOVEL PYRAZOLE DERIVATIVE PDE10A, PDE3A, PDE5A AXL 4093/4885PIM1 2159/4885CCNA2 4462/4885

“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.