SCHEMBL19600981

SCHEMBL19600981

CC1=C(CN2CC(C(=O)O)C2)CCc2cc(OC3CCCCC3)ccc21

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 20/20 0.63
S1PR3 Q99500 11/20 0.63

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
SCHEMBL19583402 1.00 S1PR1 (0.63) S1PR1S1PR3
SCHEMBL29874504 1.00 S1PR1 (0.63) S1PR1S1PR3
SCHEMBL29874910 0.99 S1PR1 (0.64) S1PR1S1PR3
SCHEMBL17815750 0.99 S1PR1 (0.64) S1PR1S1PR3
SCHEMBL19433003 0.94 S1PR1 (0.57) S1PR1S1PR3
SCHEMBL17815752 0.94 S1PR1 (0.57) S1PR1S1PR3
SCHEMBL29874210 0.94 S1PR1 (0.57) S1PR1S1PR3
SCHEMBL29874456 0.94 S1PR1 (0.57) S1PR1S1PR3
SCHEMBL19432993 0.91 S1PR1 (0.62) S1PR1S1PR3
SCHEMBL17815541 0.90 S1PR1 (0.54) S1PR1S1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327439-A1 DIHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2017-11-16 US disclosed
US-20170327439-A1 DIHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2017-11-16 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-20170327439-A1 DIHYDRONAPHTHALENE DERIVATIVE S1PR5, LPAR5, S1PR1 S1PR1 3/4885S1PR3 8/4885

“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.