SCHEMBL11099669

SCHEMBL11099669

CC(=O)Nc1ccc2c(NC=C(C(=O)O)C(=O)O)ncnc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.56
ABCG2 Q9UNQ0 1/20 0.49
KDM4E B2RXH2 4/20 0.43
MAPT P10636 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ERBB2 P04626 1/20 0.43
GLA P06280 1/20 0.43
TNNI3 P19429 1/20 0.43
TNNT2 P45379 1/20 0.43
TNNC1 P63316 1/20 0.43
RUNX1 Q01196 1/20 0.43
CBFB Q13951 1/20 0.43
CSF1R P07333 2/20 0.42
PABPC1 P11940 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAP4K4 O95819 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL10967478 0.90 EGFR (0.56) EGFRABCG2ERBB2MAP4K4
SCHEMBL10975752 0.87 EGFR (0.43) EGFRABCG2KDM4EMAPTNPC1
SCHEMBL10972030 0.84 EGFR (0.50) EGFRABCG2KDM4EMAPTERBB2
SCHEMBL11093656 0.82 KMT2A (0.44) EGFRKDM4EMAPTNPC1RAB9A
SCHEMBL10966820 0.80 KDM4E (0.44) EGFRKDM4ENPC1RAB9AMEN1
SCHEMBL27758517 0.79 EGFR (0.76) EGFRABCG2ERBB2CSF1RMAP4K4
SCHEMBL10970610 0.78 FYN (0.48) EGFRKDM4ENPC1RAB9AERBB2
SCHEMBL10967809 0.78 FYN (0.60) EGFRERBB2MAP4K4
SCHEMBL10969619 0.77 FYN (0.53) EGFRERBB2
SCHEMBL10967842 0.77 IRAK4 (0.41) EGFRKDM4EMAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0030156-B1 QUINAZOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-03-21 EP disclosed
US-4429126-A ANTIASTHMA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-01-31 US disclosed
US-4377580-A ANTIALLERGENIC AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-03-22 US disclosed
EP-0030156-A1 Quinazoline derivatives, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-06-10 EP disclosed