SCHEMBL4070500

SCHEMBL4070500

CC(=O)c1cnc(Nc2ccc(N3CCNCC3)cn2)nc1NCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STAT6 P42226 7/20 0.68
SYK P43405 1/20 0.56
CCND3 P30281 7/20 0.54
CDK6 Q00534 6/20 0.54
CCNK O75909 2/20 0.54
CDK9 P50750 2/20 0.54
CCNA2 P20248 1/20 0.54
CDK2 P24941 1/20 0.54
CDK4 P11802 6/20 0.54
CCND1 P24385 5/20 0.54
CCND2 P30279 1/20 0.54

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
SCHEMBL4067711 0.88 CCND3 (0.58) STAT6SYKCCND3CDK6CCNK
SCHEMBL2386837 0.81 STAT6 (1.00) STAT6SYK
SCHEMBL4067757 0.81 CDK4 (0.64) SYKCCND3CDK6CCNKCDK9
SCHEMBL4065441 0.81 CDK4 (0.61) CCND3CDK6CCNKCDK9CCNA2
SCHEMBL4071177 0.75 IGF1R (0.62) STAT6CCND3CDK6CCNKCDK9
SCHEMBL4066350 0.73 CDK4 (0.56) CCND3CDK6CCNKCDK9CCNA2
SCHEMBL4073235 0.72 CDK4 (0.64) CCND3CDK6CCNKCDK9CCNA2
SCHEMBL4076077 0.72 SYK (0.61) SYKCCND3CDK6CCNKCDK9
SCHEMBL736067 0.72 SYK (1.00) STAT6SYK
SCHEMBL4069339 0.72 SYK (0.59) SYKCCND3CDK6CCNKCDK9

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
EP-1590341-B1 2-AMINOPYRIDINE SUBSTITUTED HETEROCYCLES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2009-06-17 EP claimed
US-20040236084-A1 E.g., 4-Cyclopentylamino-2-(5-piperazin-1-yl-pyridin-2-ylamino)-pyrimidine-5-carbonitrile; potent inhibitors of cyclin-dependent kinases useful in treating cell proliferative disorders PFIZER INC 2004-11-25 US claimed
EP-1590341-B1 2-AMINOPYRIDINE SUBSTITUTED HETEROCYCLES AS INHIBITORS OF CELLULAR PROLIFERATION WARNER LAMBERT CO (US) 2009-06-17 EP disclosed
US-20090030005-A1 Combinations for the treatment of cancer AMGEN INC. (US) 2009-01-29 US disclosed
EP-1740184-A1 COMBINATIONS OF SIGNAL TRANSDUCTION INHIBITORS Pfizer Products Incorporated (US) 2007-01-10 EP disclosed
WO-2005094830-A1 COMBINATIONS OF SIGNAL TRANSDUCTION INHIBITORS PFIZER PRODUCTS INC. (US) 2005-10-13 WO disclosed
US-20050222163-A1 Combinations of signal transduction inhibitors PFIZER INC 2005-10-06 US disclosed
US-20040236084-A1 E.g., 4-Cyclopentylamino-2-(5-piperazin-1-yl-pyridin-2-ylamino)-pyrimidine-5-carbonitrile; potent inhibitors of cyclin-dependent kinases useful in treating cell proliferative disorders PFIZER INC 2004-11-25 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 (2 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-20040236084-A1 E.g., 4-Cyclopentylamino-2-(5-piperazin-1-yl-pyridin-2-ylamino)-pyrimidine-5-carbonitrile; potent inhibitors of cyclin-dependent kinases useful in treating cell proliferative disorders CDK4, CCNA1, CCNI STAT6 1684/4885SYK 2974/4885CCND3 32/4885
US-20050222163-A1 Combinations of signal transduction inhibitors CDK4, CDK3, CDK2 STAT6 123/4885SYK 354/4885CCND3 103/4885

“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.