SCHEMBL11029792

SCHEMBL11029792

COc1cc(N2CCN(C)CC2)ccc1Nc1cc(C(C)c2cccc(F)c2)cnc1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNA2 P20248 1/20 0.50
▸ CDK2 P24941 1/20 0.50
▸ PLK1 P53350 1/20 0.50
▸ CCNA1 P78396 1/20 0.50
▸ PLK3 Q9H4B4 1/20 0.50
▸ PLK2 Q9NYY3 1/20 0.50
▸ PIM1 P11309 2/20 0.49
▸ TTK P33981 2/20 0.49
▸ PIM2 Q9P1W9 1/20 0.49
▸ ALK Q9UM73 4/20 0.48
▸ JAK3 P52333 1/20 0.47
▸ IGF1R P08069 4/20 0.46
▸ TNK2 Q07912 2/20 0.45
▸ MAPK7 Q13164 2/20 0.45
▸ LRRK2 Q5S007 1/20 0.45
▸ MAP3K7 O43318 1/20 0.45
▸ PTK2 Q05397 1/20 0.45
▸ CCNT1 O60563 1/20 0.45
▸ CDK4 P11802 1/20 0.45
▸ CCND1 P24385 1/20 0.45

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
SCHEMBL11028698 0.86 CDK4 (0.51) CCNA2CDK2ALKJAK3PTK2
SCHEMBL11029902 0.80 CSF1R (0.44) JAK3CDK4CCND1
SCHEMBL11029725 0.80 CCNA2 (0.58) CCNA2CDK2PLK1CCNA1PLK3
SCHEMBL11027507 0.77 ALK (0.52) ALK
SCHEMBL11026445 0.76 EGFR (0.51) CCNA2CDK2PLK1CCNA1PLK3
SCHEMBL11033146 0.76 ALK (0.58) CCNA2CDK2PLK1CCNA1PLK3
SCHEMBL11033999 0.76 SLC2A1 (0.51) CCNA2CDK2PIM1TTKPIM2
SCHEMBL11027989 0.76 CCNT1 (0.53) CCNA2CDK2PLK1CCNA1PLK3
SCHEMBL11029699 0.75 ALK (0.57) ALK
SCHEMBL11026741 0.72 FYN (0.55) CCNA2CDK2CCNT1CDK4CCND1

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 8 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
EP-2665711-A1 PICOLINAMIDE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-11-27 — — EP claimed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — WO 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 CCNA2 403/4885CDK2 18/4885PLK1 126/4885

“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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