SCHEMBL428508

SCHEMBL428508

O=C1CC(Cc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.50
CYP19A1 P11511 1/20 0.47
CCR3 P51677 2/20 0.46
ALOX15 P16050 1/20 0.45
GRIN2B Q13224 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
KMT2A Q03164 1/20 0.44
SIGMAR1 Q99720 3/20 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
SCHEMBL13454194 0.91 GAA (0.50) GBA1CYP19A1CCR3ALOX15GRIN2B
SCHEMBL15114430 0.84 GRIN2B (0.44) GBA1CCR3GRIN2BALDH1A1SIGMAR1
SCHEMBL4865561 0.84 GBA1 (0.48) GBA1CYP19A1CCR3GRIN2BSIGMAR1
SCHEMBL4865573 0.84 GBA1 (0.48) GBA1CYP19A1CCR3GRIN2BSIGMAR1
SCHEMBL5136681 0.82 EP300 (0.44) GBA1CYP19A1ALDH1A1KMT2A
SCHEMBL5136682 0.82 EP300 (0.44) GBA1CYP19A1ALDH1A1KMT2A
SCHEMBL6261865 0.81 GBA1 (0.46) GBA1CYP19A1CCR3ALOX15GRIN2B
SCHEMBL11359163 0.81 HDAC8 (0.50) GBA1CYP19A1CCR3ALOX15MEN1
SCHEMBL3982415 0.81 NOS3 (0.50) GBA1CYP19A1CCR3GRIN2BSIGMAR1
SCHEMBL20005917 0.80 CYP3A4 (0.45)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12338203-B2 Urea compound for antagonizing LPA1 receptor TAISHO PHARMACEUTICAL CO., LTD. (JP) 2025-06-24 US disclosed
CN-119823001-A Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-15 CN disclosed
CN-114206832-B Urea compounds antagonizing LPA1 receptor 大正制药株式会社 2025-04-04 CN disclosed
CN-115960750-A Baeyer-Villiger monooxygenase, mutant and application thereof in preparation of chiral butyrolactone 华东理工大学 2023-04-14 CN disclosed
US-20230097871-A1 UREA COMPOUND FOR ANTAGONIZING LPA1 RECEPTOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2023-03-30 US disclosed
EP-4008405-A1 UREA COMPOUND FOR ANTAGONIZING LPA1 RECEPTOR Taisho Pharmaceutical Co., Ltd. (JP) 2022-06-08 EP disclosed
EP-2172459-B1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME TOKUYAMA CORP (JP) 2014-03-19 EP disclosed
US-8404860-B2 Compound having hydantoin ring and method of producing the same TOKUYAMA CORPORATION (JP) 2013-03-26 US disclosed
US-20120289705-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME SHIIGI HIROFUMI (JP) 2012-11-15 US disclosed
US-8258313-B2 Compound having hydantoin ring and method of producing the same TOKUYAMA CORPORATION (JP) 2012-09-04 US disclosed
US-20080280879-A1 SUBSTITUTED HETEROCYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS PFIZER INC 2008-11-13 US disclosed
CN-1178911-C pyrrolidine and piperidine derivatives and their use for the treatment of neurodegenerative diseases - 2004-12-08 CN disclosed
EP-1278728-B1 PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS HOFFMANN LA ROCHE (CH) 2004-08-25 EP disclosed
WO-2004054564-A1 GABAPENTIN ANALOGUES FOR FIBROMYALGIA AND OTHER RELATED DISORDERS WARNER-LAMBERT COMPANY LLC (US) 2004-07-01 WO disclosed
CN-1425002-A Pyrrolidine and piperidine derivatives and their use for treatment of neurodegenerative disorders HOFFMANN LA ROCHE (CH) 2003-06-18 CN disclosed
EP-1278728-A1 PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2003-01-29 EP disclosed
US-6451819-B2 PYRROLIDINE-3-YL-SULFANYL, OR SUFONYL OR SUFINYL DERIVATIVES USED IN THE TREATMENT OF NEURODEGENERATIVE DISEASES HOFFMANN-LA ROCHE INC. 2002-09-17 US disclosed
US-20010047031-A1 Heterocyclic compounds useful as NMDA receptor selective subtype blockers HOFFMANN-LA ROCHE INC. 2001-11-29 US disclosed
WO-2001081303-A1 PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREAMENT OF NEURODEGENERATIVE DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-01 WO disclosed
US-4020171-A CHEMICAL INTERMEDIATES SAGAMI CHEMICAL RESEARCH CENTER (JA) 1977-04-26 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-20120289705-A1 COMPOUND HAVING HYDANTOIN RING AND METHOD OF PRODUCING THE SAME CASP14, CYP8B1, DDT GBA1 725/4885CYP19A1 314/4885CCR3 2901/4885
US-12338203-B2 Urea compound for antagonizing LPA1 receptor LPAR1, LPAR2, LPAR3 GBA1 960/4885CYP19A1 3832/4885CCR3 2924/4885
US-20230097871-A1 UREA COMPOUND FOR ANTAGONIZING LPA1 RECEPTOR LPAR1, LPAR2, LPAR3 GBA1 960/4885CYP19A1 3832/4885CCR3 2924/4885
US-20080280879-A1 SUBSTITUTED HETEROCYCLIC DERIVATIVES AND THEIR PHARMACEUTICAL USE AND COMPOSITIONS XDH, CYP2D6, F12 GBA1 2575/4885CYP19A1 708/4885CCR3 647/4885
US-20010047031-A1 Heterocyclic compounds useful as NMDA receptor selective subtype blockers GRIN1, GRM1, GRIN2B GBA1 1681/4885CYP19A1 3265/4885CCR3 1537/4885

“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.