SCHEMBL11031767

SCHEMBL11031767

CN1CCN(c2ccc(Nc3cc(-c4cnn(C)c4)cnc3C(N)=O)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC2A1 P11166 2/20 0.50
▸ CDK2 P24941 3/20 0.47
▸ AURKA O14965 2/20 0.47
▸ CCNA2 P20248 2/20 0.47
▸ CDK4 P11802 1/20 0.47
▸ CCND3 P30281 1/20 0.47
▸ CDK6 Q00534 1/20 0.47
▸ GSK3B P49841 2/20 0.47
▸ DYRK1A Q13627 2/20 0.47
▸ TTK P33981 2/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ PIM1 P11309 1/20 0.46
▸ PIM2 Q9P1W9 1/20 0.46
▸ ACVRL1 P37023 1/20 0.46
▸ ACVR1 Q04771 1/20 0.46
▸ SYK P43405 2/20 0.46
▸ CCNA1 P78396 1/20 0.45
▸ EGFR P00533 1/20 0.45
▸ EML4 Q9HC35 2/20 0.44
▸ ALK Q9UM73 2/20 0.44

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
SCHEMBL11029599 0.88 MAPKAPK2 (0.58) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11030064 0.86 CHEK1 (0.56) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11031445 0.85 SLC2A1 (0.51) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11026741 0.85 FYN (0.55) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11029346 0.85 MAPKAPK2 (0.61) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11027433 0.84 MAPKAPK2 (0.60) SLC2A1CDK2AURKACDK4CDK6
SCHEMBL11030051 0.84 SLC2A1 (0.57) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11029349 0.84 SLC2A1 (0.49) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11028611 0.83 SLC2A1 (0.51) SLC2A1CDK2AURKACCNA2CDK4
SCHEMBL11031519 0.82 SLC2A1 (0.57) SLC2A1CDK4CDK6GSK3BEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859546-B2 Picolinamide inhibitors of kinases ABBVIE INC. (US) 2014-10-14 — — US claimed
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — US claimed
US-8859546-B2 Picolinamide inhibitors of kinases ABBVIE INC. (US) 2014-10-14 — — US disclosed
EP-2665711-A1 PICOLINAMIDE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-11-27 — — EP disclosed
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — US disclosed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — 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-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ALK, PKN2, ERBB2 SLC2A1 3662/4885CDK2 18/4885AURKA 26/4885

“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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