SCHEMBL11484789

SCHEMBL11484789

COc1ccc(SC(C)C(C)Nc2nc(Cl)nc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.46
▸ PDGFRB P09619 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ APP P05067 4/20 0.43
▸ SYK P43405 1/20 0.42
▸ NPY5R Q15761 1/20 0.41
▸ MERTK Q12866 2/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KDM1A O60341 1/20 0.40
▸ RAD52 P43351 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ PDE5A O76074 1/20 0.40
▸ AURKA O14965 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ AURKB Q96GD4 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TP53 P04637 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
SCHEMBL3119002 0.74 NPY5R (0.71) NPY5RMERTKABCG2POLBKMT2A
SCHEMBL2845653 0.71 APP (0.76) APPMERTKPOLBKMT2APDE5A
SCHEMBL1685041 0.71 APP (0.74) EGFRAPPPOLBPDE5ALMNA
Hydrochloric Acid SCHEMBL1685081 0.70 APP (0.72) EGFRAPPPOLBKMT2APDE5A
SCHEMBL25243367 0.69 MAPT (0.67) APPKMT2AMEN1PDE5ALMNA
SCHEMBL11255646 0.69 GBA1 (0.61) APPKMT2AMEN1PDE5AACP1
SCHEMBL11255510 0.68 GBA1 (0.55) APPPOLBKMT2AMEN1PDE5A
SCHEMBL11246446 0.68 GBA1 (0.54) APPPOLBKMT2AMEN1PDE5A
SCHEMBL3113616 0.67 MAPT (0.72) ABCG2POLBKMT2AMEN1LMNA
SCHEMBL3110337 0.67 KMT2A (0.67) APPPOLBKMT2AMEN1RAD52

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
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 — — US disclosed
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