SCHEMBL7464568

SCHEMBL7464568

Cc1cc(C)cc(Nc2nc(C)cc(-c3cccnc3)n2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.57
BCR P11274 5/20 0.57
KDR P35968 2/20 0.51
ALDH1A1 P00352 1/20 0.50
PDGFRA P16234 2/20 0.49
PRKCA P17252 4/20 0.49
PRKCD Q05655 3/20 0.48
PRKD3 O94806 1/20 0.48
PRKCG P05129 1/20 0.48
PRKCB P05771 1/20 0.48
LCK P06239 1/20 0.48
PRKCH P24723 1/20 0.48
PRKCI P41743 1/20 0.48
ZAP70 P43403 1/20 0.48
PRKCE Q02156 1/20 0.48
PRKCQ Q04759 1/20 0.48
PRKCZ Q05513 1/20 0.48
PRKD1 Q15139 1/20 0.48
EGFR P00533 2/20 0.48
SRC P12931 1/20 0.48

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
SCHEMBL2081665 0.84 ABL1 (0.70) ABL1BCRKDRALDH1A1PDGFRA
SCHEMBL7469833 0.83 ABL1 (0.81) ABL1BCRKDRPDGFRAPRKCA
SCHEMBL14041713 0.80 ABL1 (0.75) ABL1BCRKDRPDGFRAPRKCA
SCHEMBL1797323 0.79 CYP2A6 (0.64) ABL1BCRALDH1A1CYP2A6CYP19A1
SCHEMBL17070834 0.78 ABL1 (0.72) ABL1BCRKDRPDGFRAPRKCA
SCHEMBL10073332 0.77 CYP2A6 (0.68) ABL1BCRALDH1A1CYP2A6CYP19A1
SCHEMBL20402767 0.76 CYP2A6 (0.56) ABL1BCRALDH1A1CYP2A6CYP19A1
SCHEMBL206240 0.76 MEN1 (0.73) ALDH1A1TDP1KMT2ALMNATP53
SCHEMBL1796850 0.76 CYP2A6 (0.59) ALDH1A1PRKCACYP2A6CYP19A1KMT2A
SCHEMBL15046260 0.76 CYP2A6 (0.59) ALDH1A1CYP2A6CYP19A1KMT2ALMNA

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
EP-0233461-B2 4,5,6-Substituted-2-pyrimidinamines AMERICAN CYANAMID CO (US) 2002-05-29 EP disclosed