SCHEMBL23588289

SCHEMBL23588289

CCOP(=O)(OCC)C(Cc1nc(-c2ccc(OCc3ccccc3)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 5/20 0.46
▸ PPARA Q07869 5/20 0.46
▸ SMPD1 P17405 5/20 0.45
▸ FFAR1 O14842 4/20 0.44
▸ MITF O75030 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ NCOA3 Q9Y6Q9 1/20 0.44
▸ RAB9A P51151 4/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ POLB P06746 2/20 0.42
▸ ADRB2 P07550 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL23588079 0.88 ACACB (0.46) SMPD1FFAR1MITFTP53NCOA3
SCHEMBL30689362 0.85 MITF (0.39) PPARDPPARAMITFTP53NCOA3
SCHEMBL25804401 0.84 TSHR (0.47) TP53RAB9ANPC1NPSR1MAPT
SCHEMBL25807564 0.84 TP53 (0.39) MITFTP53NCOA3RAB9ANPC1
SCHEMBL23588293 0.84 HTT (0.40) MITFTP53NCOA3RAB9ANPC1
SCHEMBL23588294 0.84 TP53 (0.39) MITFTP53NCOA3RAB9ANPC1
SCHEMBL25804667 0.82 SPHK1 (0.43) FFAR1MITFTP53NCOA3RAB9A
SCHEMBL23578218 0.82 SPHK1 (0.47) FFAR1
SCHEMBL23588138 0.81 TP53 (0.37) MITFTP53NCOA3RAB9ANPC1
SCHEMBL23578561 0.81 GPR119 (0.39) MITFTP53NCOA3POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4081511-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES Sitryx Therapeutics Limited (GB) 2022-11-02 — — EP disclosed
CN-115066418-A Carboxy derivatives with anti-inflammatory properties 西特瑞治疗有限公司 2022-09-16 — — CN disclosed
WO-2021130492-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2021-07-01 — — WO disclosed
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