SCHEMBL4687

SCHEMBL4687

C[C@@H]1NC(=O)O[C@@H]1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 11/20 0.49
CA2 P00918 1/20 0.48
SLC6A2 P23975 1/20 0.46
ADRA1A P35348 1/20 0.46
HTR2B P41595 1/20 0.46
SLC6A3 Q01959 1/20 0.46
CYP2D6 P10635 1/20 0.45

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
SCHEMBL338191 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL4291 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL3119262 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL8192290 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL5835621 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL5544656 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL8532996 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL6374631 1.00 GRM5 (0.49) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL27504027 0.98 GRM5 (0.48) GRM5CA2SLC6A2ADRA1AHTR2B
SCHEMBL5196221 0.91 GRM5 (0.57) GRM5CA2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024040267-A2 DIRECT SYNTHESIS OF N-(3-SUBSTITUTED-CHROMAN-4-YL)-7H- PYRROLO[2,3-D]PYRIMIDIN-4-AMINES AND DERIVATIVES THEREOF MITOKININ, INC. (US) 2024-02-22 WO claimed
EP-0925292-B1 PROCESSES AND INTERMEDIATES FOR PREPARING SUBSTITUTED CHROMANOL DERIVATIVES PFIZER (US) 2003-09-10 EP claimed
US-12465580-B2 Substituted fatty acids for treating non-alcoholic steatohepatitis BASF AS (NO) 2025-11-11 US disclosed
US-12440466-B2 Fatty acid derivatives for treating non-alcoholic steatohepatitis BASF AS (NO) 2025-10-14 US disclosed
CN-120136861-A 2-Aryl-6-aryloxy methylmorpholine derivative and application thereof 安徽景星医药技术有限公司 2025-06-13 CN disclosed
EP-3340988-B1 ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES AFASCI INC (US) 2025-04-09 EP disclosed
EP-3720431-B1 FATTY ACID DERIVATIVES FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS BASF AS (NO) 2024-10-30 EP disclosed
EP-3288550-B1 STRUCTURALLY ENHANCED FATTY ACIDS CONTAINING SULPHUR FOR THEIR USE IN TREATING NON-ALCOHOLIC STEATOHEPATITIS BASF AS (NO) 2024-06-05 EP disclosed
US-20240156769-A1 FATTY ACID DERIVATIVES FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS BASF AS (NO) 2024-05-16 US disclosed
US-20240156760-A1 SUBSTITUTED FATTY ACIDS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS BASF AS (NO) 2024-05-16 US disclosed
US-11925614-B2 Fatty acid derivatives for treating non-alcoholic steatohepatitis BASF AS (NO) 2024-03-12 US disclosed
US-5380925-A Cyclic amino acids and derivatives thereof WARNER-LAMBERT COMPANY (US) 1995-01-10 US disclosed
WO-1994011361-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES THE UPJOHN COMPANY (US) 1994-05-26 WO disclosed
WO-1994007849-A1 PROCESS FOR THE STEREOSELECTIVE SYNTHESIS OF 3-SUBSTITUTED 2-THIOMETHYL PROPIONIC ACIDS HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-14 WO disclosed
US-5264577-A Cyclic amino acids and derivatives thereof WARNER-LAMBERT COMPANY (US) 1993-11-23 US disclosed
WO-1993021176-A1 NOVEL CYCLIC AMINO ACIDS AND DERIVATIVES THEREOF WARNER-LAMBERT COMPANY (US) 1993-10-28 WO disclosed
WO-1993015042-A1 PROCESS FOR THE PREPARATION OF D(-) AND L(+)-3,3-DIPHENYLALANINE AND D(-) AND L(+)-SUBSTITUTED 3,3-DIPHENYLALANINES AND DERIVATIVES THEREOF WARNER-LAMBERT COMPANY (US) 1993-08-05 WO disclosed
US-5198548-A Chemical intermediates for angiotensins WARNER-LAMBERT COMPANY (US) 1993-03-30 US disclosed
US-5179208-A Analgesics KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1993-01-12 US disclosed
US-5145993-A Process for preparing D-2-(6-methoxy-2-naphthyl)-propionic acid and intermediate thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-09-08 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-12465580-B2 Substituted fatty acids for treating non-alcoholic steatohepatitis SLC10A1, LIPC, FABP1 GRM5 1587/4885CA2 2416/4885SLC6A2 778/4885
US-20240156769-A1 FATTY ACID DERIVATIVES FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS CPT1A, NR1H2, NR1H3 GRM5 1595/4885CA2 3197/4885SLC6A2 2556/4885
US-20240156760-A1 SUBSTITUTED FATTY ACIDS FOR TREATING NON-ALCOHOLIC STEATOHEPATITIS SLC10A1, LIPC, FABP1 GRM5 1587/4885CA2 2416/4885SLC6A2 778/4885
US-12440466-B2 Fatty acid derivatives for treating non-alcoholic steatohepatitis CPT1A, NR1H2, NR1H3 GRM5 1595/4885CA2 3197/4885SLC6A2 2556/4885
US-11925614-B2 Fatty acid derivatives for treating non-alcoholic steatohepatitis CPT1A, NR1H3, NR1H2 GRM5 1534/4885CA2 3049/4885SLC6A2 2518/4885

“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.