SCHEMBL10662765

SCHEMBL10662765

COc1cccc(N=C2SC(=CC(=O)O)C(=O)N2c2cccc(OC)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 3/20 0.51
▸ S1PR1 P21453 3/20 0.50
▸ S1PR3 Q99500 3/20 0.50
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ ALDH1A1 P00352 4/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MAPT P10636 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MGAM O43451 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ SI P14410 1/20 0.43
▸ MGAM2 Q2M2H8 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ DUSP22 Q9NRW4 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL10662753 1.00 FAAH (0.51) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10665584 0.84 MEN1 (0.48) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10665587 0.84 MEN1 (0.48) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10667719 0.82 FAAH (0.71) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10667710 0.82 FAAH (0.71) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10666221 0.76 FAAH (0.52) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10666213 0.76 FAAH (0.52) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10660623 0.76 FAAH (0.48) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL10660629 0.76 FAAH (0.48) FAAHS1PR1S1PR3MEN1KMT2A
SCHEMBL19107398 0.74 FAAH (0.58) FAAHS1PR1S1PR3MEN1KMT2A

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-4775677-A ANTIALLERGNES, ANTIINFLAMMATORY AGENTS, CARDIOVASCULAR DISORDERS WARNER-LAMBERT COMPANY (US) 1988-10-04 — — US claimed
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