SCHEMBL18978465

SCHEMBL18978465

CCCCCCCCCCCCc1ccc(C(=O)N2CCC[C@H]2C)cc1

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 12/20 0.70
SPHK2 Q9NRA0 4/20 0.69
GAA P10253 1/20 0.61
HPGD P15428 1/20 0.61
HRH3 Q9Y5N1 2/20 0.51
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA7 P43166 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
THRA P10827 1/20 0.50
THRB P10828 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL18978451 1.00 SPHK1 (0.70) SPHK1SPHK2GAAHPGDHRH3
SCHEMBL18978575 1.00 SPHK1 (0.70) SPHK1SPHK2GAAHPGDHRH3
SCHEMBL13761356 0.95 GAA (0.64) SPHK1SPHK2GAAHPGDHRH3
SCHEMBL18978464 0.85 SPHK1 (0.70) SPHK1SPHK2GAAHPGDHRH3
SCHEMBL6281922 0.85 SPHK1 (0.60) SPHK1SPHK2THRATHRB
SCHEMBL15935942 0.85 SPHK1 (0.67) SPHK1SPHK2
SCHEMBL19732173 0.85 SPHK1 (0.70) SPHK1SPHK2THRATHRB
SCHEMBL15935933 0.85 SPHK1 (0.67) SPHK1SPHK2
SCHEMBL18978683 0.83 SPHK1 (0.67) SPHK1SPHK2THRATHRBL3MBTL1
SCHEMBL1164411 0.83 SPHK1 (0.64) SPHK1SPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210040215-A1 METHODS FOR ENHANCING THE POTENCY OF THE IMMUNE CHECKPOINT INHIBITORS Université Toulouse III - Paul Sabatier (FR) 2021-02-11 US disclosed
US-20190031757-A1 METHODS FOR ENHANCING THE POTENCY OF THE IMMUNE CHECKPOINT INHIBITORS INSERM (Institut National de la Santé et de la Recherche Médicale (FR) 2019-01-31 US disclosed
US-9908849-B2 Imidamide sphingosine kinase inhibitors UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2018-03-06 US disclosed
US-20170166525-A1 IMIDAMIDE SPHINGOSINE KINASE INHIBITORS UNIVERSITY OF VIRGINIA 2017-06-15 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-20190031757-A1 METHODS FOR ENHANCING THE POTENCY OF THE IMMUNE CHECKPOINT INHIBITORS CD274, PDCD1, PDCD1LG2 SPHK1 96/4885SPHK2 270/4885GAA 2334/4885
US-20210040215-A1 METHODS FOR ENHANCING THE POTENCY OF THE IMMUNE CHECKPOINT INHIBITORS CD274, PDCD1, PDCD1LG2 SPHK1 96/4885SPHK2 270/4885GAA 2334/4885
US-20170166525-A1 IMIDAMIDE SPHINGOSINE KINASE INHIBITORS SPHK2, SPHK1, S1PR2 SPHK1 2/4885SPHK2 1/4885GAA 3892/4885

“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.