SCHEMBL9054643

SCHEMBL9054643

Cc1c(F)c(=O)oc2cc(N)ccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 3/20 0.67
SRC P12931 2/20 0.57
KDM4E B2RXH2 7/20 0.54
ALDH1A1 P00352 7/20 0.54
HPGD P15428 7/20 0.54
GAA P10253 4/20 0.54
HSD17B10 Q99714 3/20 0.54
CASP1 P29466 2/20 0.54
CASP7 P55210 2/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
GLA P06280 1/20 0.54
CA9 Q16790 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 2/20 0.48
HIF1A Q16665 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
ATM Q13315 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
SCHEMBL2000840 0.86 SRC (0.63) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL17716551 0.80 SRC (0.57) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL30675224 0.80 HSD17B3 (1.00) HSD17B3KDM4EALDH1A1HPGDGAA
SCHEMBL10791978 0.80 HSD17B3 (1.00) HSD17B3KDM4EALDH1A1HPGDGAA
SCHEMBL11981284 0.78 SRC (0.74) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL22100633 0.78 SRC (0.58) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL2321714 0.77 KDM4E (0.54) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL6888225 0.76 SRC (0.53) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL22364114 0.76 SRC (0.68) HSD17B3SRCKDM4EALDH1A1HPGD
SCHEMBL8679670 0.76 SRC (0.53) HSD17B3SRCKDM4EALDH1A1HPGD

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108220458-A A kind of deoxyribozyme probe for detecting staphylococcus aureus and its application 清华大学深圳研究生院 2018-06-29 CN claimed
CN-109661439-A Fluorogenic water-solvated conjugated polymers 贝克顿·迪金森公司 2019-04-19 CN disclosed
EP-0347771-B1 Device for enhancing fluorescence and kinetics and methods of using the device BECTON DICKINSON CO (US) 1996-08-14 EP disclosed
EP-0347771-A2 Device for enhancing fluorescence and kinetics and methods of using the device Becton, Dickinson and Company (US) 1989-12-27 EP disclosed