SCHEMBL86971

SCHEMBL86971

c1ccc2c(c1)COC21CCNCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.53
OPRD1 P41143 1/20 0.45
AVPR1A P37288 3/20 0.44

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
SCHEMBL31415656 1.00 SIGMAR1 (0.53) SIGMAR1OPRD1AVPR1A
SCHEMBL8871048 1.00 SIGMAR1 (0.53) SIGMAR1OPRD1AVPR1A
Methane SCHEMBL6919510 0.98 SIGMAR1 (0.51) SIGMAR1OPRD1AVPR1A
Hydrochloric Acid SCHEMBL78480 0.98 SIGMAR1 (0.51) SIGMAR1OPRD1AVPR1A
Hydrochloric Acid SCHEMBL29717167 0.98 SIGMAR1 (0.51) SIGMAR1OPRD1AVPR1A
Ethane SCHEMBL8577252 0.96 SIGMAR1 (0.54) SIGMAR1OPRD1AVPR1A
SCHEMBL2330750 0.93 SIGMAR1 (0.48) SIGMAR1OPRD1AVPR1A
Propane SCHEMBL8890366 0.93 SIGMAR1 (0.51) SIGMAR1AVPR1A
Butane SCHEMBL8604221 0.92 SIGMAR1 (0.50) SIGMAR1AVPR1A
SCHEMBL31059145 0.89 HTR2A (0.49) SIGMAR1OPRD1

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 442 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320125-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS FOR THE TREATMENT OF CANCER Bristol-Myers Squibb Company (US) 2024-02-14 EP claimed
US-7320978-B2 Oxazole derivatives, preparation and therapeutic use thereof SANOFI-AVENTIS (FR) 2008-01-22 US claimed
US-20070043060-A1 OXAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2007-02-22 US claimed
EP-1716142-A2 OXAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEROF Sanofi-Aventis (FR) 2006-11-02 EP claimed
WO-2005080357-A2 OXAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEROF SANOFI-AVENTIS (FR) 2005-09-01 WO claimed
EP-4747251-A1 APOL1 INHIBITORS AND METHODS OF USE Maze Therapeutics, Inc. (US) 2026-05-27 EP disclosed
US-20250066378-A1 SPIRO-OXAZOLONES HOFFMANN-LA ROCHE INC. (US) 2025-02-27 US disclosed
WO-2025019479-A1 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2025-01-23 WO disclosed
WO-2025010314-A1 UREA-CONTAINING AGONISTS OF OREXIN RECEPTOR TYPE 2 VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-01-09 WO disclosed
US-12162887-B2 Spiro-oxazolones HOFFMANN-LA ROCHE INC. (US) 2024-12-10 US disclosed
US-20240216516-A1 GLUTARIMIDE-CONTAINING KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF TIGER BIOTHERAPEUTICS INC. 2024-07-04 US disclosed
US-20240217972-A1 GLUTARIMIDE-CONTAINING PAN-KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF TIGER BIOTHERAPEUTICS INC. 2024-07-04 US disclosed
US-4260623-A Hexahydro-1-arylspiro(3H-oxazolo(3,4-A)pyridine-3,4'-piperidene) antidepressants, pharmaceutical compositions thereof and method of use thereof WARNER-LAMBERT COMPANY (US) 1981-04-07 US disclosed
EP-0002283-A1 Substituted 1,3-dihydrospiro (benzo(c)thiophenes), process for their preparation and these compounds for use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1979-06-13 EP disclosed
US-4031224-A 1,3-Dihydro-heteroarylspiro (isobenzofuran)s AMERICAN HOECHST CORPORATION (US) 1977-06-21 US disclosed
US-4024263-A ANALGESIC, ANTICONVULSANT, ANTIDEPRESSANT AMERICAN HOECHST CORPORATION (US) 1977-05-17 US disclosed
US-4024263-A ANALGESIC, ANTICONVULSANT, ANTIDEPRESSANT AMERICAN HOECHST CORPORATION (US) 1977-05-17 US disclosed
US-4024263-A ANALGESIC, ANTICONVULSANT, ANTIDEPRESSANT AMERICAN HOECHST CORPORATION (US) 1977-05-17 US disclosed
US-3985889-A 1,3-DIHYDROSPIRO(ISOBENZOFURAN); ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-10-12 US disclosed
US-3962259-A TRANQUILIZERS, ANALGETIC AGENTS AMERICAN HOECHST CORPORATION (US) 1976-06-08 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 (5 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-20240216516-A1 GLUTARIMIDE-CONTAINING KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF KRAS, VHL, HRAS SIGMAR1 4755/4885OPRD1 4765/4885AVPR1A 3453/4885
US-12162887-B2 Spiro-oxazolones AVPR1A, AVPR1B, AVPR2 SIGMAR1 178/4885OPRD1 6/4885AVPR1A 1/4885
US-20250066378-A1 SPIRO-OXAZOLONES AVPR1A, AVPR1B, AVPR2 SIGMAR1 178/4885OPRD1 6/4885AVPR1A 1/4885
US-20240217972-A1 GLUTARIMIDE-CONTAINING PAN-KRAS-MUTANT DEGRADER COMPOUNDS AND USES THEREOF KRAS, VHL, HRAS SIGMAR1 4454/4885OPRD1 4564/4885AVPR1A 3588/4885
US-20070043060-A1 OXAZOLE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF OXA1L, ARG2, CYP3A7 SIGMAR1 161/4885OPRD1 194/4885AVPR1A 293/4885

“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.