SCHEMBL6275030

SCHEMBL6275030

Brc1cnc(Nc2ccc3cc[nH]c3c2)nc1NCCc1ccccn1.Brc1cnc(Nc2ccc3cc[nH]c3c2)nc1NCc1ccccn1.Cc1cc2cc(Nc3ncc(Br)c(NCc4ccccn4)n3)ccc2[nH]1.Cc1cc2cc(Nc3nccc(NCc4ccccn4)n3)ccc2[nH]1.c1ccc(CNc2ccnc(Nc3ccc4cc[nH]c4c3)n2)nc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 8/20 0.47
PTK2B Q14289 6/20 0.47
IGF1R P08069 5/20 0.44
FGFR1 P11362 2/20 0.44
KDR P35968 2/20 0.44
EGFR P00533 3/20 0.40
F2 P00734 2/20 0.38
SYK P43405 1/20 0.37
CDK1 P06493 1/20 0.36

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
SCHEMBL6214288 0.85 PTK2 (0.49) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6210394 0.84 PTK2 (0.60) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6212362 0.84 PTK2 (0.53) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6211607 0.82 PTK2 (0.64) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6211439 0.82 PTK2 (0.53) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6212334 0.81 PTK2 (0.64) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6209954 0.81 IGF1R (0.51) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6210739 0.81 SYK (0.50) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6255244 0.80 PTK2 (0.47) PTK2PTK2BIGF1RFGFR1KDR
SCHEMBL6213157 0.79 PTK2 (0.61) PTK2PTK2BIGF1RFGFR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578732-A2 PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF ABNORMAL CELL GROWTH Pfizer Products Inc. (US) 2005-09-28 EP disclosed
WO-2004056786-A2 PYRIMIDINE DERIVATES FOR THE TREATMENT OF ABNORMAL CELL GROWTH PFIZER PRODUCTS INC. (US) 2004-07-08 WO disclosed