SCHEMBL28304570

SCHEMBL28304570

CCCCCCl.O=C(Cl)c1cc(F)ccc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.47
CES1 P23141 3/20 0.47
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
HTR7 P34969 1/20 0.38
MDM2 Q00987 3/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RIPK1 Q13546 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CHRNA7 P36544 1/20 0.37
RARB P10826 2/20 0.36
RARA P10276 1/20 0.36
RARG P13631 1/20 0.36
FAAH O00519 1/20 0.36

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
Methylene Chloride SCHEMBL28312143 0.84 CES2 (0.61) CES2CES1ALDH1A1ALOX15MDM2
SCHEMBL343535 0.82 CES2 (0.68) CES2CES1ALDH1A1ALOX15MDM2
SCHEMBL20472214 0.78 MEN1 (0.51) ALDH1A1MEN1HPGDKMT2ANPSR1
SCHEMBL18861017 0.77 MCL1 (0.52) RARBRARA
SCHEMBL18861020 0.77 PTPN11 (0.53) TSHR
SCHEMBL28672289 0.75 TSHR (0.49) CES2CES1ALDH1A1ALOX15MEN1
SCHEMBL15037828 0.74 CES2 (0.53) CES2CES1ALDH1A1HTR7MDM2
SCHEMBL29127613 0.74 CES2 (0.53) CES2CES1ALDH1A1HTR7MDM2
SCHEMBL29406527 0.74 CES2 (0.53) CES2CES1ALDH1A1HTR7MDM2
SCHEMBL28062364 0.74 HTR7 (0.59) CES2CES1ALDH1A1HTR7MEN1

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-105764514-B Aminopyridine derivatives as inhibitors of TAM family kinases 圣诺康生命科学公司 2019-07-12 CN disclosed