SCHEMBL11240698

SCHEMBL11240698

COc1ccccc1OC(C)CNc1ncnc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.56
▸ LDHA P00338 1/20 0.53
▸ EGFR P00533 4/20 0.52
▸ NR2F2 P24468 3/20 0.52
▸ ABCG2 Q9UNQ0 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ SMN1; SMN2 Q16637 8/20 0.49
▸ RAB9A P51151 4/20 0.49
▸ GAA P10253 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MAPK1 P28482 4/20 0.47
▸ MTNR1A P48039 1/20 0.47
▸ MTNR1B P49286 1/20 0.47
▸ GALR3 O60755 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL11247814 0.88 LDHA (0.50) APPLDHAEGFRNR2F2POLB
SCHEMBL11240408 0.86 LDHA (0.49) APPLDHAEGFRNR2F2POLB
SCHEMBL11248690 0.85 APP (0.54) APPLDHAEGFRNR2F2ABCG2
SCHEMBL11249827 0.83 GBA1 (0.57) APPLDHAEGFRNR2F2ABCG2
SCHEMBL11258725 0.80 RAB9A (0.54) APPLDHAEGFRNR2F2POLB
SCHEMBL11245980 0.79 EGFR (0.57) APPLDHAEGFRNR2F2POLB
SCHEMBL11260225 0.79 GBA1 (0.55) APPLDHAEGFRNR2F2POLB
SCHEMBL11248987 0.79 SMN1; SMN2 (0.53) APPLDHAEGFRNR2F2ABCG2
SCHEMBL11262398 0.78 LDHA (0.72) APPLDHAEGFRNR2F2ABCG2
SCHEMBL16259077 0.78 EGFR (0.59) APPLDHAEGFRNR2F2ABCG2

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
US-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 — — US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 — — US disclosed
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