SCHEMBL26691029

SCHEMBL26691029

CCCCCCCCCCc1ccc(-c2noc(CCCN(C)C(=O)O)n2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 7/20 0.58
▸ S1PR1 P21453 2/20 0.53
▸ S1PR2 O95136 1/20 0.53
▸ S1PR3 Q99500 1/20 0.53
▸ LPAR2 Q9HBW0 1/20 0.53
▸ SPHK2 Q9NRA0 1/20 0.52
▸ S1PR5 Q9H228 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ NPC1 O15118 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ RAB9A P51151 1/20 0.48

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
SCHEMBL26887345 0.86 SPHK1 (0.62) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL29496372 0.86 SPHK1 (0.53) SPHK1S1PR1S1PR2S1PR3LPAR2
Hydrochloric Acid SCHEMBL26690798 0.85 SPHK1 (0.61) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL26690971 0.83 SPHK1 (0.53) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL26691005 0.81 SPHK1 (0.59) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL15176282 0.81 SPHK1 (0.61) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL26691013 0.81 SPHK1 (0.61) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL23588257 0.81 SPHK1 (0.58) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL3264894 0.81 SPHK1 (0.67) SPHK1S1PR1S1PR2S1PR3LPAR2
SCHEMBL26690939 0.80 SPHK1 (0.60) SPHK1S1PR1S1PR2S1PR3LPAR2

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-20230373937-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-11-23 — — US 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-20230373937-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 SPHK1 491/4885S1PR1 610/4885S1PR2 139/4885

“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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