SCHEMBL10825738

SCHEMBL10825738

CC(=O)c1ccc(Oc2ccc(Cl)c3ccccc23)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 5/20 0.68
FFAR1 O14842 1/20 0.54
MAPT P10636 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
RAB9A P51151 2/20 0.53
HPGD P15428 1/20 0.53
TSHR P16473 2/20 0.50
NPC1 O15118 1/20 0.50
LMNA P02545 3/20 0.48
MAOB P27338 2/20 0.48
MAOA P21397 1/20 0.48
TDP1 Q9NUW8 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SIRT5 Q9NXA8 1/20 0.41
KDM4E B2RXH2 2/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX12 P18054 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL4786081 0.84 MAPT (0.64) ESRRAMAPTSMN1; SMN2RAB9AHPGD
SCHEMBL11511159 0.81 MAPT (0.60) ESRRAMAPTRAB9AHPGDLMNA
SCHEMBL10825749 0.78 HPGD (0.56) ESRRAMAPTSMN1; SMN2RAB9AHPGD
SCHEMBL10825715 0.77 ESRRA (0.52) ESRRAFFAR1MAPTSMN1; SMN2RAB9A
SCHEMBL4543869 0.77 ESR1 (0.57) ESRRAMAPTSMN1; SMN2RAB9AHPGD
SCHEMBL9619575 0.77 ESR1 (0.57) ESRRAMAPTSMN1; SMN2RAB9AHPGD
SCHEMBL822859 0.76 MAPT (0.57) ESRRAMAPTHPGDLMNAMEN1
SCHEMBL11564627 0.76 ESRRA (0.61) ESRRAFFAR1MAPTSMN1; SMN2RAB9A
SCHEMBL1284188 0.76 MAPT (0.54) ESRRAFFAR1MAPTHPGDMAOB
SCHEMBL10964527 0.76 ESRRA (0.56) ESRRAFFAR1MAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4592876-A Arylglyoxals AMERICAN CYANAMID COMPANY (US) 1986-06-03 US disclosed
US-4474810-A HYPOGLYCEMIC AGENTS, ANTIDIABETIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-10-02 US disclosed
EP-0114389-A2 Substituted arylglyoxal derivatives AMERICAN CYANAMID COMPANY (US) 1984-08-01 EP disclosed
US-4168385-A LOWERING OF STEROL AND TRIGLYCERIDE SERUM LEVELS AMERICAN CYANAMID COMPANY (US) 1979-09-18 US disclosed
US-4125729-A Hypolipemic α-aryloxy para substituted phenyl acetic acid compounds AMERICAN CYANAMID COMPANY (US) 1978-11-14 US disclosed