SCHEMBL31130516

SCHEMBL31130516

COC(=O)c1cc(-c2cccc(OC3CC3)c2)n(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SLC16A3 O15427 9/20 0.64
▸ SLC16A1 P53985 9/20 0.64
▸ FAAH O00519 3/20 0.62
▸ MARS1 P56192 4/20 0.51
▸ MGLL Q99685 2/20 0.49
▸ RPA1 P27694 1/20 0.48
▸ SMPD1 P17405 1/20 0.47
▸ CNR1 P21554 1/20 0.46

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
SCHEMBL31130142 0.93 SLC16A3 (0.64) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130515 0.90 SLC16A3 (0.63) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130238 0.83 SLC16A3 (0.62) SLC16A3SLC16A1FAAHMGLL
SCHEMBL27238371 0.83 SLC16A3 (0.63) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130486 0.83 SLC16A3 (0.63) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130379 0.83 SLC16A3 (0.64) SLC16A3SLC16A1FAAHMGLL
SCHEMBL9418677 0.83 MARS1 (0.72) FAAHMARS1RPA1SMPD1CNR1
SCHEMBL31130324 0.82 SLC16A3 (0.63) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130533 0.81 SLC16A3 (0.51) SLC16A3SLC16A1FAAHMGLL
SCHEMBL31130143 0.81 SLC16A3 (0.70) SLC16A3SLC16A1FAAH

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
EP-4442318-A2 HETEROCYCLIC INHIBITORS OF MCT4 Vettore, LLC (US) 2024-10-09 — — EP disclosed
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