SCHEMBL7966689

SCHEMBL7966689

COc1cc2ncnc(Nc3ccc4[nH]ccc4c3)c2cc1-c1ccccn1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RET P07949 6/20 0.62
EGFR P00533 11/20 0.59
ERBB2 P04626 4/20 0.59
ATM Q13315 1/20 0.59
KDR P35968 5/20 0.51
EPHA2 P29317 1/20 0.51
EPHB4 P54760 1/20 0.51
CLK1 P49759 1/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
IGF1R P08069 1/20 0.49
TEK Q02763 1/20 0.49
KIF5B P33176 1/20 0.48
LCK P06239 2/20 0.48
AURKB Q96GD4 2/20 0.48
AURKA O14965 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
SCHEMBL7980588 0.88 RET (0.61) RETEGFRERBB2ATMKDR
SCHEMBL8561433 0.85 RET (0.83) RETEGFRERBB2KDRCLK1
SCHEMBL7980148 0.85 PRKD1 (0.46) RETEGFRERBB2ATMKDR
SCHEMBL8552331 0.85 EGFR (0.50) RETEGFRERBB2ATMKDR
Hydrochloric Acid SCHEMBL8904802 0.84 RET (0.81) RETEGFRERBB2KDRCLK1
SCHEMBL7966337 0.84 RET (0.60) RETEGFRERBB2KDRCLK1
SCHEMBL7978607 0.84 EGFR (0.60) RETEGFRERBB2KDREPHA2
SCHEMBL7966561 0.84 RET (0.60) RETEGFRERBB2KDRCLK1
SCHEMBL7966847 0.83 RET (0.59) RETEGFRERBB2KDRCLK1
SCHEMBL7980146 0.83 RET (0.59) RETEGFRERBB2ATMKDR

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
US-6225318-B1 4-aminoquinazolone derivatives PFIZER INC 2001-05-01 US claimed
EP-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP claimed
US-6225318-B1 4-aminoquinazolone derivatives PFIZER INC 2001-05-01 US disclosed
EP-0837063-A1 4-Aminoquinazoline derivatives PFIZER INC. (US) 1998-04-22 EP disclosed