SCHEMBL7180807

SCHEMBL7180807

COc1c(OC)c(C(C)C)c2cc(C)c(Cc3ccccc3)cc2c1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 10/20 0.71
▸ LDHB P07195 9/20 0.71
▸ ALB P02768 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ AKR1B1 P15121 3/20 0.40
▸ CNR2 P34972 2/20 0.40
▸ GPR55 Q9Y2T6 2/20 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
SCHEMBL8026977 0.88 LDHA (0.74) LDHALDHBALBAKR1B1
SCHEMBL7174190 0.85 LDHA (0.67) LDHALDHBMEN1ALDH1A1LMNA
SCHEMBL7186216 0.84 LDHA (0.62) LDHALDHBALBKDM4EMEN1
SCHEMBL7183463 0.83 LDHA (1.00) LDHALDHBALB
SCHEMBL7180813 0.81 LDHA (0.70) LDHALDHBKDM4EMEN1ALDH1A1
SCHEMBL2622272 0.80 ALB (0.65) LDHALDHBALBKDM4EMEN1
SCHEMBL7179527 0.76 LDHA (0.86) LDHALDHBALB
SCHEMBL8038885 0.76 LDHA (0.48) LDHALDHBKDM4EALDH1A1HPGD
SCHEMBL7180825 0.76 LDHA (0.86) LDHALDHBALBCNR2GPR55
SCHEMBL8460263 0.75 LDHA (0.65) LDHALDHBALBKDM4EMEN1

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
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