SCHEMBL9047779

SCHEMBL9047779

O=C1C/C(=C\c2c(Cl)cccc2Cl)C(=O)O1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
DYRK2 Q92630 1/20 0.34
CCR3 P51677 1/20 0.34
HSP90AA1 P07900 1/20 0.33
AHR P35869 1/20 0.33
IKBKB O14920 1/20 0.32
MAOA P21397 3/20 0.31
MAOB P27338 3/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL9047791 1.00 MEN1 (0.41) MEN1ALDH1A1KMT2ATDP1CYP1A2
SCHEMBL9047790 0.81 DYRK2 (0.56) ALDH1A1DYRK2
SCHEMBL9047786 0.81 DYRK2 (0.56) ALDH1A1DYRK2
SCHEMBL980510 0.79 MAOB (0.43) MEN1ALDH1A1KMT2ATDP1CYP1A2
SCHEMBL980512 0.79 MAOB (0.43) MEN1ALDH1A1KMT2ATDP1CYP1A2
SCHEMBL9046794 0.79 KDM4E (0.34) MEN1ALDH1A1KMT2ACYP1A2CYP3A4
SCHEMBL9047782 0.75 AKR1C3 (0.50) CYP1A2MAOAMAOB
SCHEMBL9047523 0.75 AKR1C3 (0.50) CYP1A2MAOAMAOB
SCHEMBL9048733 0.75 CA12 (0.41) ALDH1A1CYP1A2CYP3A4CYP2C19MAOB
SCHEMBL9048726 0.75 CA12 (0.41) ALDH1A1CYP1A2CYP3A4CYP2C19MAOB

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-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed