SCHEMBL19196477

SCHEMBL19196477

CC(C)(C)OC(=O)NC(c1ccccc1)c1nc(-c2ccccc2)no1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
S1PR3 Q99500 10/20 0.60
S1PR1 P21453 6/20 0.57
S1PR4 O95977 3/20 0.57
S1PR5 Q9H228 2/20 0.55
S1PR2 O95136 1/20 0.55
TDP1 Q9NUW8 1/20 0.47
ACACB O00763 5/20 0.47
PPARD Q03181 2/20 0.47
PPARA Q07869 2/20 0.47
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
GABRB1 P18505 1/20 0.43
GABRB2 P47870 1/20 0.43

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
SCHEMBL22637183 0.90 S1PR3 (0.55) S1PR3S1PR1S1PR4S1PR5S1PR2
SCHEMBL29485563 0.86 TDP1 (0.61) TDP1ACACBPPARDPPARA
SCHEMBL1610078 0.85 TDP1 (0.48) S1PR3S1PR1S1PR4TDP1ACACB
SCHEMBL7001607 0.81 ALDH1A1 (0.57) S1PR4TDP1PPARDPPARALMNA
SCHEMBL19195739 0.80 S1PR3 (0.78) S1PR3S1PR1S1PR4S1PR5S1PR2
SCHEMBL3622689 0.80 LMNA (0.44) S1PR3S1PR1TDP1ACACBPPARD
SCHEMBL5521975 0.80 LMNA (0.44) S1PR3S1PR1TDP1ACACBPPARD
SCHEMBL3622690 0.80 LMNA (0.44) S1PR3S1PR1TDP1ACACBPPARD
SCHEMBL25497267 0.78 CTSK (0.45) S1PR3PPARDPPARAGABRB1GABRB2
SCHEMBL14820895 0.78 CTSK (0.57) PPARALMNATSHRGABRB1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034691-B2 Sphinogosine-1 -phosphate receptor modulators for treatment of cardiopulmonary disorders THE SCRIPPS RESEARCH INSTITUTE (US) 2021-06-15 US disclosed
US-20190300527-A1 SPHINOGOSINE-1-PHOSPHATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS THE SCRIPPS RESEARCH INSTITUTE 2019-10-03 US disclosed
US-10323029-B2 Sphinogosine-1-phosphate receptor modulators for treatment of cardiopulmonary disorders THE SCRIPPS RESEARCH INSTITUTE (US) 2019-06-18 US disclosed
US-20170217963-A1 SPHINOGOSINE-1-PHOSPHATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS THE SCRIPPS RESEARCH INSTITUTE 2017-08-03 US disclosed
US-20170217963-A1 SPHINOGOSINE-1-PHOSPHATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS THE SCRIPPS RESEARCH INSTITUTE 2017-08-03 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 (4 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-20170217963-A1 SPHINOGOSINE-1-PHOSPHATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS S1PR1, SPHK1, S1PR3 S1PR3 3/4885S1PR1 1/4885S1PR4 5/4885
US-11034691-B2 Sphinogosine-1 -phosphate receptor modulators for treatment of cardiopulmonary disorders S1PR1, SPHK1, S1PR3 S1PR3 3/4885S1PR1 1/4885S1PR4 5/4885
US-20190300527-A1 SPHINOGOSINE-1-PHOSPHATE RECEPTOR MODULATORS FOR TREATMENT OF CARDIOPULMONARY DISORDERS S1PR1, SPHK1, S1PR3 S1PR3 3/4885S1PR1 1/4885S1PR4 5/4885
US-10323029-B2 Sphinogosine-1-phosphate receptor modulators for treatment of cardiopulmonary disorders S1PR1, SPHK1, S1PR3 S1PR3 3/4885S1PR1 1/4885S1PR4 5/4885

“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.