SCHEMBL30165795

SCHEMBL30165795

O=c1oc2cc(F)ccc2cc1-c1nc2ccccc2s1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.74
▸ PIK3CB P42338 1/20 0.74
▸ ALK Q9UM73 2/20 0.56
▸ MAPT P10636 9/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ APP P05067 1/20 0.47
▸ HPGD P15428 7/20 0.46
▸ SMN1; SMN2 Q16637 6/20 0.46
▸ NPSR1 Q6W5P4 4/20 0.46
▸ MIF P14174 2/20 0.45
▸ TP53 P04637 4/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ KDM4E B2RXH2 7/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ RAB9A P51151 5/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ CASP1 P29466 2/20 0.44
▸ CASP7 P55210 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ GLA P06280 4/20 0.44

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
SCHEMBL15065694 1.00 PIK3CD (0.74) PIK3CDPIK3CBALKMAPTMCL1
SCHEMBL4586333 0.85 PIK3CD (0.74) PIK3CDPIK3CBALKMAPTHPGD
SCHEMBL29427470 0.85 PIK3CD (1.00) PIK3CDPIK3CBALKMAPTMCL1
SCHEMBL592311 0.85 PIK3CD (1.00) PIK3CDPIK3CBALKMAPTMCL1
SCHEMBL29524563 0.85 PIK3CD (1.00) PIK3CDPIK3CBALKMAPTMCL1
SCHEMBL2623784 0.85 PIK3CD (0.74) PIK3CDPIK3CBALKMAPTAPP
SCHEMBL14753532 0.85 PIK3CD (0.74) PIK3CDPIK3CBALKMAPTAPP
SCHEMBL24910436 0.84 PIK3CD (0.54) PIK3CDPIK3CBALKMAPTMCL1
SCHEMBL30674288 0.83 PIK3CD (0.71) PIK3CDPIK3CBALKMAPTAPP
SCHEMBL12040001 0.83 PIK3CD (0.71) PIK3CDPIK3CBALKMAPTAPP

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
CN-112654681-B Exocyclic amine substituted coumarin compound and application thereof as fluorescent marker 伊卢米纳剑桥有限公司 2023-01-06 — — CN disclosed
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