SCHEMBL7215634

SCHEMBL7215634

Nc1nc(Nc2cccc(Br)c2)c2c(n1)[nH]c1ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 1.00
KDR P35968 9/20 0.56
FLT1 P17948 7/20 0.56
PDGFRB P09619 5/20 0.55
ABL1 P00519 1/20 0.52
ABL2 P42684 1/20 0.52
BRAF P15056 1/20 0.51

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
SCHEMBL7222290 0.84 EGFR (1.00) EGFRPDGFRBABL1ABL2BRAF
Hydrochloric Acid SCHEMBL7217999 0.82 EGFR (0.97) EGFRPDGFRBABL1ABL2BRAF
SCHEMBL1367436 0.77 PDGFRB (0.63) EGFRKDRPDGFRBABL1ABL2
SCHEMBL16146468 0.71 BRAF (0.67) EGFRKDRFLT1PDGFRBBRAF
SCHEMBL1923985 0.71 EGFR (0.63) EGFRKDRPDGFRB
SCHEMBL7221479 0.69 EGFR (1.00) EGFRABL1ABL2
SCHEMBL16009388 0.68 EGFR (0.60) EGFRKDRPDGFRBABL1ABL2
SCHEMBL7497652 0.68 EGFR (1.00) EGFRPDGFRBABL1ABL2BRAF
Hydrochloric Acid SCHEMBL7215766 0.68 EGFR (0.98) EGFRABL1ABL2
SCHEMBL2779096 0.68 BRAF (0.52) EGFRKDRBRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6596726-B1 Method of inhibiting epidermal growth factor by treating, with an effective inhibiting amount, a mammal, in need thereof inhibit the epidermal growth factor receptor and related receptors and, in particular, their tyrosine kinase enzyme WARNER LAMBERT COMPANY 2003-07-22 US disclosed
EP-0741711-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1996-11-13 EP disclosed
WO-1995019970-A1 TRICYCLIC COMPOUNDS CAPABLE OF INHIBITING TYROSINE KINASES OF THE EPIDERMAL GROWTH FACTOR RECEPTOR FAMILY WARNER-LAMBERT COMPANY (US) 1995-07-27 WO disclosed