SCHEMBL314468

SCHEMBL314468

Ic1cccc(OCc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APP P05067 5/20 0.63
MAOB P27338 5/20 0.62
NR4A2 P43354 1/20 0.62
BCHE P06276 3/20 0.59
CYP4F2 P78329 1/20 0.59
CYP4A11 Q02928 1/20 0.59
MAOA P21397 1/20 0.57
ALOX5 P09917 1/20 0.56
SMPD1 P17405 1/20 0.55
LCK P06239 1/20 0.54
SRD5A2 P31213 1/20 0.54

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
SCHEMBL5708191 0.96 APP (0.59) APPMAOBNR4A2BCHECYP4F2
Formaldehyde SCHEMBL27783224 0.95 NR4A2 (0.61) APPMAOBNR4A2BCHECYP4F2
SCHEMBL3916599 0.89 APP (0.63) APPMAOBBCHECYP4F2CYP4A11
SCHEMBL30674750 0.89 APP (0.63) APPMAOBBCHECYP4F2CYP4A11
SCHEMBL32665169 0.88 APP (0.59) APPMAOBNR4A2MAOAALOX5
SCHEMBL5708187 0.87 APP (0.61) APPMAOBBCHECYP4F2CYP4A11
SCHEMBL1268719 0.86 MAOB (0.81) MAOBNR4A2BCHECYP4F2CYP4A11
SCHEMBL5708184 0.85 APP (0.59) APPMAOBBCHECYP4F2CYP4A11
SCHEMBL9221966 0.84 APP (0.62) APPMAOBNR4A2BCHECYP4F2
SCHEMBL13452238 0.84 APP (0.54) APPMAOBNR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12502376-B2 Pyrano[4,3-b]indole derivatives as alpha-1-antitrypsin modulators for treating alpha-1-antitrypsin deficiency (AATD) VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-12-23 US disclosed
US-12441714-B2 Pyrrolidine compounds ELI LILLY AND COMPANY (US) 2025-10-14 US disclosed
US-20250171399-A1 PYRROLIDINE COMPOUNDS ELI LILLY AND COMPANY 2025-05-29 US disclosed
CN-118974013-A Pyrrolidine compounds 伊莱利利公司 2024-11-15 CN disclosed
US-12053459-B2 CDK2 inhibitors and methods of using the same CEDILLA THERAPEUTICS, INC. (MA) 2024-08-06 US disclosed
EP-4157844-B1 4-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-3,6-DIHYDROPYRIDINE-1-(2H)-CARBOXAMIDE DERIVATIVES AS LIMK AND/OR ROCK KINASES INHIBITORS FOR USE IN THE TREATMENT OF CANCER CENTRE NAT RECH SCIENT (FR) 2024-07-10 EP disclosed
EP-4358954-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2024-05-01 EP disclosed
CN-117561058-A CDK2 inhibitors and methods of use thereof 塞迪拉治疗股份有限公司 2024-02-13 CN disclosed
WO-2024006776-A1 ESTROGEN RECEPTOR ALPHA DEGRADERS AND MEDICAL USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-01-04 WO disclosed
US-20230312576-A1 4-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-3,6-DIHYDROPYRIDINE-1-(2H)-CARBOXAMIDE DERIVATIVES AS LIMK AND/OR ROCK KINASES INHIBITORS FOR USE IN THE TREATMENT OF CANCER UNIVERSITÉ DE TOURS (FR) 2023-10-05 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-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
WO-2000051984-A1 2-ARYL INDOLE DERIVATIVES AS ANTAGONISTS OF TACHYKININS MERCK SHARP & DOHME LIMITED (GB) 2000-09-08 WO disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 US disclosed
CN-1202152-A Novel 4- (oxoxyphenyl) -3-oxopiperidines for the treatment of cardiac and renal insufficiency HOFFMANN LA ROCHE (CH) 1998-12-16 CN disclosed
CN-1031266-C Process for preparation of heterocycle ether derivatives ZENECA LTD (GB) 1996-03-13 CN disclosed
EP-0402110-B1 Optical active compounds and liquid crystal compositions containing such compounds WAKO PURE CHEM IND LTD (JP) 1994-12-14 EP disclosed
US-5128062-A OPTICALLY ACTIVE COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SUCH COMPOUNDS WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1992-07-07 US disclosed
EP-0402110-A1 Optical active compounds and liquid crystal compositions containing such compounds WAKO PURE CHEMICAL INDUSTRIES LTD (JP) 1990-12-12 EP disclosed
CN-1046903-A Process for preparing heterocyclic ether derivatives ICI PLC (GB) 1990-11-14 CN 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-12502376-B2 Pyrano[4,3-b]indole derivatives as alpha-1-antitrypsin modulators for treating alpha-1-antitrypsin deficiency (AATD) SERPINA2, SERPINB1, SERPINE1 APP 436/4885MAOB 161/4885NR4A2 2917/4885
US-20250171399-A1 PYRROLIDINE COMPOUNDS SDHA, GMPS, SDHB APP 2554/4885MAOB 567/4885NR4A2 4807/4885
US-12053459-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK2AP2 APP 4386/4885MAOB 2610/4885NR4A2 3309/4885
US-12441714-B2 Pyrrolidine compounds ADCYAP1R1, AVPR2, NPPA APP 1957/4885MAOB 1663/4885NR4A2 4655/4885
US-20230312576-A1 4-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-3,6-DIHYDROPYRIDINE-1-(2H)-CARBOXAMIDE DERIVATIVES AS LIMK AND/OR ROCK KINASES INHIBITORS FOR USE IN THE TREATMENT OF CANCER LIMK1, LIMK2, ROCK1 APP 979/4885MAOB 2144/4885NR4A2 3677/4885

“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.