SCHEMBL11026812

SCHEMBL11026812

Nc1nc2ccccn2c1-c1cccnc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 2/20 0.60
▸ MAPK1 P28482 3/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 3/20 0.47
▸ RAD51 Q06609 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ CDK4 P11802 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ GLA P06280 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ CASP7 P55210 1/20 0.41
▸ KDR P35968 3/20 0.40
▸ PTK2 Q05397 2/20 0.40

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
SCHEMBL11031736 0.84 USP7 (0.63) USP7KDM4EGAAALDH1A1HSD17B10
SCHEMBL19048703 0.84 USP7 (0.76) USP7KDM4EGAAALDH1A1HSD17B10
SCHEMBL11028623 0.83 USP7 (0.69) USP7KDM4EGAARAD51ALDH1A1
SCHEMBL756111 0.81 USP7 (0.43) USP7KDM4EGAAALDH1A1HSD17B10
SCHEMBL3077074 0.78 MAPK1 (0.47) USP7MAPK1KDM4EGAARAD51
SCHEMBL3070139 0.78 KDM4E (0.47) MAPK1KDM4EGAARAD51ALDH1A1
SCHEMBL22615013 0.76 NR1I3 (0.52) MAPK1KDM4EGAANPC1RAB9A
SCHEMBL14411866 0.75 MAPK1 (0.47) USP7MAPK1KDM4EGAARAD51
SCHEMBL1730262 0.74 MARK4 (0.52) MAPK1KDM4EGAARAD51HPGD
SCHEMBL11027795 0.73 USP7 (0.52) USP7KDM4EGAAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 — — 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD USP7 3522/4885MAPK1 281/4885KDM4E 1665/4885

“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.

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