SCHEMBL8397955

SCHEMBL8397955

CCOC(=O)C1Cc2ccccc2CC1C(=O)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
NR1D1 P20393 1/20 0.44
FABP7 O15540 1/20 0.44
FABP5 Q01469 1/20 0.44
MAPT P10636 1/20 0.44
PKM P14618 1/20 0.44
F2 P00734 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL8397958 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2HPGDLMNA
SCHEMBL8397951 1.00 ALDH1A1 (0.47) ALDH1A1CA1CA2HPGDLMNA
SCHEMBL8399606 0.92 ALDH1A1 (0.50) ALDH1A1CA1CA2HPGDLMNA
SCHEMBL14193309 0.89 NR1D1 (0.48) ALDH1A1HPGDTSHRNR1D1MAPT
SCHEMBL4815395 0.89 NR1D1 (0.48) ALDH1A1HPGDTSHRNR1D1MAPT
SCHEMBL19318895 0.88 HPGD (0.49) ALDH1A1CA1CA2HPGDTSHR
SCHEMBL8399607 0.88 FABP7 (0.50) ALDH1A1CA1CA2HPGDTSHR
SCHEMBL8401362 0.86 MAPT (0.47) ALDH1A1HPGDLMNATSHRNR1D1
SCHEMBL4822683 0.86 MAPT (0.47) ALDH1A1HPGDLMNATSHRNR1D1
SCHEMBL8401366 0.86 MAPT (0.47) ALDH1A1HPGDLMNATSHRNR1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869518-A USEFUL IN THE TREATMENT OF OBESITY AND HYPERGLYCEMIA SYNTHELABO (FR) 1999-02-09 US disclosed