SCHEMBL11243312

SCHEMBL11243312

Brc1ccc(OCCNc2ncnc3ccccc23)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 1/20 0.64
▸ PIK3CD O00329 1/20 0.62
▸ PIK3R1 P27986 1/20 0.62
▸ LMNA P02545 7/20 0.55
▸ HTT P42858 6/20 0.55
▸ EGFR P00533 4/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ APP P05067 2/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ GAA P10253 3/20 0.52
▸ ALPG P10696 1/20 0.52
▸ S1PR2 O95136 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ NR2F2 P24468 3/20 0.52
▸ POLB P06746 1/20 0.52
▸ MAPT P10636 3/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ GALR3 O60755 2/20 0.50

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
SCHEMBL11260593 0.89 PIK3CD (0.71) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11249743 0.86 PIK3CD (0.73) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11258419 0.86 LDHA (0.64) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11256733 0.86 LDHA (0.64) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11251531 0.86 LDHA (0.72) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11249387 0.86 LDHA (0.68) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11246622 0.85 PIK3CD (0.66) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11246662 0.83 LDHA (0.64) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11249931 0.83 SMN1; SMN2 (0.64) LDHAPIK3CDPIK3R1LMNAHTT
SCHEMBL11240638 0.83 EGFR (0.68) LDHAPIK3CDPIK3R1LMNAHTT

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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