SCHEMBL11258725

SCHEMBL11258725

Cc1ccc(OC(C)CNc2ncnc3ccccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ NPC1 O15118 5/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ MAPT P10636 2/20 0.54
▸ EGFR P00533 5/20 0.52
▸ NR2F2 P24468 4/20 0.52
▸ POLB P06746 2/20 0.52
▸ MAPK1 P28482 3/20 0.51
▸ LDHA P00338 1/20 0.50
▸ GAA P10253 3/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ GBA1 P04062 1/20 0.48
▸ GALR3 O60755 3/20 0.47
▸ LMNA P02545 3/20 0.46
▸ ALPG P10696 1/20 0.46
▸ S1PR2 O95136 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ HTT P42858 3/20 0.46
▸ TSHR P16473 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
SCHEMBL11249827 0.91 GBA1 (0.57) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11245980 0.89 EGFR (0.57) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11248987 0.89 SMN1; SMN2 (0.53) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11260225 0.89 GBA1 (0.55) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11254363 0.87 EGFR (0.52) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11247814 0.82 LDHA (0.50) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11259342 0.81 MAP4K4 (0.55) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11260802 0.81 GBA1 (0.54) POLBGBA1APP
SCHEMBL11240698 0.80 APP (0.56) RAB9ASMN1; SMN2NPC1KMT2AMAPT
SCHEMBL11240408 0.79 LDHA (0.49) RAB9ASMN1; SMN2NPC1KMT2AMAPT

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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