SCHEMBL16934278

SCHEMBL16934278

CCCCCCCCc1ccc(-c2noc(C3CN(C(=O)OC(C)(C)C)C3)n2)cc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 15/20 0.68
SPHK1 Q9NYA1 8/20 0.68
S1PR1 P21453 1/20 0.52
S1PR5 Q9H228 1/20 0.52
CYP1A2 P05177 1/20 0.51
POLB P06746 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HTT P42858 1/20 0.51
FAAH O00519 1/20 0.48
MGLL Q99685 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
SCHEMBL16933872 1.00 SPHK2 (0.68) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL22265692 1.00 SPHK2 (0.68) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL22265749 1.00 SPHK2 (0.68) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL29523556 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL29522977 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL16934266 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL16934264 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL29522938 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL29523406 0.93 SPHK2 (0.61) SPHK2SPHK1S1PR1S1PR5CYP1A2
SCHEMBL29523317 0.92 SPHK2 (0.61) SPHK2SPHK1CYP1A2POLBCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590083-B2 Inhibitors of spinster homolog 2 (SPNS2) for use in therapy UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2026-03-31 US disclosed
US-20220089581-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-03-24 US disclosed
EP-3914592-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY University of Virginia Patent Foundation (US) 2021-12-01 EP disclosed
WO-2020154431-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY LYNCH KEVIN R (US) 2020-07-30 WO disclosed
US-9688668-B2 Long chain base sphingosine kinase inhibitors UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2017-06-27 US disclosed
US-20150210675-A1 LONG CHAIN BASE SPHINGOSINE KINASE INHIBITORS UNIVERSITY OF VIRGINIA PATENT FOUNDATION 2015-07-30 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 (3 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-20220089581-A1 INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY SPNS2, SPCS2, SMN1; SMN2 SPHK2 50/4885SPHK1 435/4885S1PR1 473/4885
US-20150210675-A1 LONG CHAIN BASE SPHINGOSINE KINASE INHIBITORS SPHK1, SPHK2, SGPL1 SPHK2 2/4885SPHK1 1/4885S1PR1 5/4885
US-12590083-B2 Inhibitors of spinster homolog 2 (SPNS2) for use in therapy SPNS2, SLC20A2, S1PR2 SPHK2 6/4885SPHK1 16/4885S1PR1 9/4885

“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.