SCHEMBL7183463

SCHEMBL7183463

Cc1cc2c(C(C)C)c(O)c(O)c(C(=O)O)c2cc1Cc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LDHA P00338 13/20 1.00
LDHB P07195 12/20 1.00
ALB P02768 4/20 0.63

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
SCHEMBL7179527 0.93 LDHA (0.86) LDHALDHBALB
SCHEMBL7180825 0.93 LDHA (0.86) LDHALDHBALB
SCHEMBL7179610 0.90 LDHA (1.00) LDHALDHBALB
SCHEMBL7182357 0.90 LDHA (0.82) LDHALDHBALB
SCHEMBL8026984 0.87 LDHA (1.00) LDHALDHBALB
SCHEMBL7179562 0.85 LDHA (1.00) LDHALDHB
SCHEMBL7180807 0.83 LDHA (0.71) LDHALDHBALB
SCHEMBL7173943 0.82 LDHA (1.00) LDHALDHBALB
SCHEMBL30417934 0.80 LDHA (1.00) LDHALDHB
SCHEMBL233361 0.80 LDHA (1.00) LDHALDHB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0980350-A4 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES UNIV NEW MEXICO (US) 2003-01-02 EP disclosed
US-6124498-A Hydroxynaphthoic acids and derivatives UNIVERSITY OF NEW MEXICO (US) 2000-09-26 US disclosed
EP-0980350-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES The University of New Mexico (US) 2000-02-23 EP disclosed
WO-1998049130-A2 HYDROXYNAPHTHOIC ACIDS AND DERIVATIVES THE UNIVERSITY OF NEW MEXICO (US) 1998-11-05 WO disclosed