SCHEMBL23588271

SCHEMBL23588271

C=C(Cc1nc(-c2ccc(CCCCC)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 7/20 0.53
▸ SPHK2 Q9NRA0 4/20 0.47
▸ S1PR1 P21453 2/20 0.44
▸ S1PR2 O95136 1/20 0.44
▸ S1PR3 Q99500 1/20 0.44
▸ LPAR2 Q9HBW0 1/20 0.44
▸ S1PR5 Q9H228 1/20 0.43

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
SCHEMBL23588102 0.97 SPHK1 (0.48) SPHK1SPHK2S1PR1S1PR5
SCHEMBL25801985 0.89 HDAC8 (0.43) SPHK1S1PR1S1PR3S1PR5
SCHEMBL23588077 0.87 ACACB (0.52) S1PR1S1PR3
SCHEMBL25801979 0.86 S1PR4 (0.44) S1PR1S1PR3S1PR5
SCHEMBL25801811 0.86 ALDH1A1 (0.37) SPHK1
SCHEMBL23588068 0.85 SPHK2 (0.42) SPHK1SPHK2
SCHEMBL23588257 0.85 SPHK1 (0.58) SPHK1SPHK2S1PR1S1PR2S1PR3
SCHEMBL25801988 0.85 SPHK1 (0.45) SPHK1
SCHEMBL25802137 0.84 MAPT (0.50) —
SCHEMBL23588349 0.83 TP53 (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 SPHK1 3875/4885SPHK2 3631/4885S1PR1 2590/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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