SCHEMBL29496342

SCHEMBL29496342

CCCCCCCCCOc1ccc(-c2noc(CCCNC(=O)OC(C)(C)C)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACB O00763 2/20 0.49
CA12 O43570 4/20 0.49
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
CA9 Q16790 4/20 0.49
MITF O75030 1/20 0.48
TP53 P04637 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
ACACA Q13085 1/20 0.47
HDAC1 Q13547 2/20 0.47
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
S1PR2 O95136 1/20 0.46
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46
LPAR2 Q9HBW0 1/20 0.46
SUCNR1 Q9BXA5 4/20 0.45
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL26887413 0.89 S1PR1 (0.54) TP53HDAC1HDAC2HDAC8S1PR2
SCHEMBL29496286 0.88 S1PR2 (0.48) TP53HDAC2HDAC8S1PR2S1PR1
SCHEMBL26690924 0.87 MITF (0.55) ACACBMITFTP53NCOA3ACACA
SCHEMBL29496326 0.86 MAPK1 (0.43) HDAC1HDAC2HDAC8S1PR2S1PR1
SCHEMBL29496353 0.85 HDAC4 (0.49) TP53HDAC1HDAC2HDAC8S1PR2
SCHEMBL29496285 0.84 SPHK2 (0.49) S1PR1HPGD
SCHEMBL24326073 0.84 SMPD1 (0.51) MITFTP53NCOA3L3MBTL1HPGD
SCHEMBL29496305 0.83 SPHK1 (0.54) TP53HDAC1HDAC2HDAC8S1PR2
SCHEMBL24326632 0.83 SIRT2 (0.48) TP53HDAC1HDAC2HDAC8HPGD
SCHEMBL27619632 0.82 SPHK1 (0.59) TP53HDAC1HDAC2HDAC8S1PR2

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
US-20230373937-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. 2023-11-23 US disclosed
EP-4210824-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY University of Virginia Patent Foundation (US) 2023-07-19 EP disclosed
WO-2022056042-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2022-03-17 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-20230373937-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 ACACB 1353/4885CA12 3791/4885CA1 4068/4885

“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.