SCHEMBL7179558

SCHEMBL7179558

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 5/20 0.56
▸ LDHB P07195 5/20 0.56
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ POLB P06746 3/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ GFER P55789 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ ATM Q13315 1/20 0.39
▸ ALB P02768 1/20 0.37
▸ GAA P10253 2/20 0.36
▸ G6PD P11413 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL7174190 0.82 LDHA (0.67) LDHALDHBKMT2AMEN1POLB
SCHEMBL7176330 0.81 LDHA (0.59) LDHALDHBKMT2AMEN1POLB
SCHEMBL7186216 0.80 LDHA (0.62) LDHALDHBKMT2AMEN1POLB
SCHEMBL7186222 0.78 LDHA (0.62) LDHALDHBKMT2AMEN1POLB
SCHEMBL10706989 0.76 LDHA (0.67) LDHALDHBKMT2AMEN1MAPT
SCHEMBL6846916 0.76 LDHA (0.61) LDHALDHBKMT2AMEN1POLB
SCHEMBL11044033 0.74 ALDH1A1 (0.48) KMT2AMEN1POLBHPGDMAPT
SCHEMBL353909 0.73 MEN1 (0.43) LDHALDHBKMT2AMEN1POLB
SCHEMBL2622272 0.73 ALB (0.65) LDHALDHBKMT2AMEN1POLB
SCHEMBL2757193 0.72 MEN1 (0.43) LDHALDHBKMT2AMEN1POLB

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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