SCHEMBL11245793

SCHEMBL11245793

CC(C)(CNc1ncnc2ccccc12)Oc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.54
▸ RAB9A P51151 4/20 0.54
▸ NR2F2 P24468 3/20 0.54
▸ GALR3 O60755 2/20 0.54
▸ LDHA P00338 1/20 0.53
▸ SMN1; SMN2 Q16637 7/20 0.52
▸ LMNA P02545 5/20 0.52
▸ HTT P42858 5/20 0.52
▸ MAPK1 P28482 2/20 0.52
▸ TSHR P16473 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ APP P05067 1/20 0.51
▸ CYP1A2 P05177 1/20 0.50
▸ GAA P10253 3/20 0.49
▸ KDR P35968 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ALPG P10696 1/20 0.49
▸ S1PR2 O95136 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL11250104 0.91 EGFR (0.52) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11260502 0.90 EGFR (0.51) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11242446 0.90 EGFR (0.57) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11248676 0.88 EGFR (0.52) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11246525 0.87 EGFR (0.51) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11249615 0.83 APP (0.56) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11246726 0.83 LDHA (0.50) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11246699 0.82 APP (0.57) LMNAHTTMAPK1TSHRAPP
SCHEMBL11256393 0.82 LDHA (0.55) EGFRRAB9ANR2F2GALR3LDHA
SCHEMBL11251106 0.82 LDHA (0.49) EGFRRAB9ANR2F2GALR3LDHA

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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