SCHEMBL4372949

SCHEMBL4372949

Fc1c(F)c2c(F)c(F)c(F)c3c4cccc5cccc(c(c1F)c23)c54

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.42
HSD17B10 Q99714 8/20 0.42
HPGD P15428 6/20 0.42
CYP1A2 P05177 5/20 0.42
THRB P10828 1/20 0.42
TSHR P16473 8/20 0.39
CYP3A4 P08684 4/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
ERBB2 P04626 1/20 0.34
FYN P06241 1/20 0.34
MAOA P21397 1/20 0.34
ACHE P22303 1/20 0.34
AHR P35869 1/20 0.34
HPRT1 P00492 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
MAPK1 P28482 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ATM Q13315 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL29060623 0.90 ALDH1A1 (0.52) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL13492570 0.87 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4318376 0.81 CYP1A2 (0.40) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL28013102 0.80 CYP1A2 (0.36) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL7908123 0.77 ALDH1A1 (0.50) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL146074 0.76 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL29531554 0.76 ALDH1A1 (0.58) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4891582 0.74 HPRT1 (0.52) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4324530 0.74 CYP1A2 (0.47) ALDH1A1HSD17B10HPGDCYP1A2THRB
SCHEMBL4501676 0.73 ALDH1A1 (0.63) ALDH1A1HSD17B10HPGDCYP1A2THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649690-B1 METHOD FOR MANUFACTURING A LITHIUM-ION BATTERY RENAULT SAS (FR) 2022-12-28 EP disclosed
CN-107534151-B Negative electrode, battery pack, electronic device, electric vehicle, power storage device, and power system 株式会社村田制作所 2021-03-19 CN disclosed
US-20090101224-A1 Joint and joining method for multilayer composite tubing and fittings ORION ENTERPRISES, INC. (US) 2009-04-23 US disclosed