SCHEMBL19201124

SCHEMBL19201124

O=C(O)CC1(CN2CCc3cccc(OCCc4cccc5ccccc45)c3CC2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
S1PR5 Q9H228 14/20 1.00
MCL1 Q07820 2/20 0.41
CASP1 P29466 1/20 0.40
FFAR4 Q5NUL3 1/20 0.39
MAOB P27338 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
BCL2 P10415 1/20 0.38

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
SCHEMBL20679829 0.84 S1PR5 (0.89) S1PR5MCL1MAOB
SCHEMBL19201155 0.82 S1PR5 (1.00) S1PR5MCL1
SCHEMBL19201126 0.78 S1PR5 (0.67) S1PR5MCL1CASP1MAOBCHRM5
SCHEMBL20573391 0.76 S1PR5 (0.68) S1PR5MCL1CASP1MAOBBCL2
SCHEMBL19201148 0.69 S1PR5 (1.00) S1PR5MCL1CASP1MAOBBCL2
SCHEMBL30828825 0.69 S1PR5 (1.00) S1PR5MCL1CASP1MAOBBCL2
SCHEMBL20573770 0.68 S1PR5 (0.74) S1PR5
SCHEMBL20573441 0.68 S1PR5 (1.00) S1PR5
SCHEMBL19201157 0.68 S1PR5 (0.75) S1PR5
SCHEMBL20679821 0.67 S1PR5 (0.82) S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3409658-B9 TETRAHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO (JP) 2024-07-17 EP disclosed
EP-3409658-B9 TETRAHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO (JP) 2024-07-17 EP disclosed
EP-3409658-B1 TETRAHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO (JP) 2024-03-06 EP disclosed
US-10730830-B2 Tetrahydronaphthalene derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2020-08-04 US disclosed
US-10730830-B2 Tetrahydronaphthalene derivative ONO PHARMACEUTICAL CO., LTD. (JP) 2020-08-04 US disclosed
US-20190031605-A1 TETRAHYDRONAPHTHALENE DERIVATIVE ONO PHARMACEUTICAL CO., LTD. (JP) 2019-01-31 US disclosed
EP-3409658-A1 TETRAHYDRONAPHTHALENE DERIVATIVE ONO Pharmaceutical Co., Ltd. (JP) 2018-12-05 EP disclosed
WO-2017131149-A1 TETRAHYDRONAPHTHALENE DERIVATIVE 小野薬品工業株式会社 2017-08-03 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 (2 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-10730830-B2 Tetrahydronaphthalene derivative S1PR5, S1PR1, GPR55 S1PR5 1/4885MCL1 2364/4885CASP1 2766/4885
US-20190031605-A1 TETRAHYDRONAPHTHALENE DERIVATIVE S1PR5, S1PR1, GPR55 S1PR5 1/4885MCL1 2223/4885CASP1 2947/4885

“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.