SCHEMBL9506410

SCHEMBL9506410

CCOCn1nccc1C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
CYP2C9 P11712 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
TSHR P16473 2/20 0.48
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.48
ABCC3 O15438 1/20 0.48
PLIN1 O60240 1/20 0.48
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
GSTA1 P08263 1/20 0.48
GSTP1 P09211 1/20 0.48
MAPT P10636 1/20 0.48
HSPD1 P10809 1/20 0.48
RECQL P46063 1/20 0.48
MAP2K6 P52564 1/20 0.48
HSPE1 P61604 1/20 0.48
GSTO1 P78417 1/20 0.48
PLIN5 Q00G26 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL10709806 0.90 ALDH1A1 (0.44) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL10553486 0.90 GSTP1 (0.52) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL9745260 0.89 CYP2C9 (0.48) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL9502467 0.89 MEN1 (0.52) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL9746104 0.87 L3MBTL1 (0.39) ALDH1A1NPSR1HTTMEN1LMNA
SCHEMBL9745131 0.82 ALDH1A1 (0.35) ALDH1A1CYP2C9NPSR1HTTMEN1
SCHEMBL9844351 0.80 MEN1 (0.47) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL9745520 0.79 CYP2C9 (0.49) ALDH1A1CYP2C9NPSR1TSHRHTT
SCHEMBL27286017 0.76 KMT2A (0.40) ALDH1A1NPSR1HTTMEN1LMNA
SCHEMBL10553919 0.75 TSHR (0.51) ALDH1A1CYP2C9NPSR1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0414931-B1 HYPOTENSIVE AGENT TANABE SEIYAKU CO (JP) 1993-07-14 EP claimed
EP-0414931-A1 Hypotensive agent TANABE SEIYAKU CO., LTD. (JP) 1991-03-06 EP claimed
EP-0414931-B1 HYPOTENSIVE AGENT TANABE SEIYAKU CO (JP) 1993-07-14 EP disclosed
EP-0268800-B1 PHENOXYACETIC ACID DERIVATIVES AND PROCESSES FOR PREPARING THE SAME Tanabe Seiyaku Co., Ltd. (JP) 1992-02-05 EP disclosed
EP-0414931-A1 Hypotensive agent TANABE SEIYAKU CO., LTD. (JP) 1991-03-06 EP disclosed
US-4853404-A DIURETIS, SALURETICS, URICOSURETICS TANABE SEIYAKU CO., LTD. (JP) 1989-08-01 US disclosed
EP-0268800-A1 Phenoxyacetic acid derivatives and processes for preparing the same Tanabe Seiyaku Co., Ltd. (JP) 1988-06-01 EP disclosed