SCHEMBL338001

SCHEMBL338001

Cc1ccc(OC(C(=O)O)C(Oc2ccc(C)cc2)C(=O)O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.51
PPARA Q07869 4/20 0.51
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
GAA P10253 1/20 0.46
CYP2C9 P11712 1/20 0.46
PKM P14618 1/20 0.46
CYP2C19 P33261 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LDHA P00338 1/20 0.45
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 1/20 0.44
NLRP1 Q9C000 1/20 0.44
ACHE P22303 1/20 0.42
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL375933 1.00 PPARG (0.51) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL1714102 1.00 PPARG (0.51) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL541965 1.00 PPARG (0.51) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL1714197 1.00 PPARG (0.51) PPARGPPARALMNAL3MBTL1KMT2A
Water SCHEMBL3347709 0.98 PPARG (0.50) PPARGPPARALMNAL3MBTL1KMT2A
Water SCHEMBL2789432 0.98 PPARG (0.50) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL27510640 0.90 PPARG (0.45) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL11708010 0.90 PPARG (0.53) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL1974348 0.88 PPARG (0.54) PPARGPPARALMNAL3MBTL1KMT2A
SCHEMBL2952466 0.88 PPARG (0.54) PPARGPPARALMNAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250230160-A1 PROCESS FOR THE PREPARATION OF 4-((6BR,10AS)-3-METHYL-2,3,6B,9,10,10A-HEXAHYDRO-1H,7H-PYRIDO[3',4':4,5]PYRROLO[1,2,3-DE]QUINOXALIN-8-YL)-1-(4-FLUORO-PHENYL)-BUTAN-1-ONE AND INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2025-07-17 US claimed
CN-118420658-B Preparation method of chiral triazine compound 天津辰欣药物研究有限公司 2024-09-20 CN claimed
CN-118420658-A Preparation method of chiral triazine compound 天津辰欣药物研究有限公司 2024-08-02 CN claimed
CN-117964625-A Preparation method of high-optical-purity ponatinib intermediate 安徽万邦医药科技股份有限公司 2024-05-03 CN claimed
WO-2023195027-A1 PROCESS FOR THE PREPARATION OF 4-((6BR,10AS)-3-METHYL-2,3,6B,9,10,10A-HEXAHYDRO-1H,7H-PYRIDO[3',4':4,5]PYRROLO[1,2,3-DE]QUINOXALIN-8-YL)-1-(4-FLUORO-PHENYL)-BUTAN-1-ONE AND INTERMEDIATES THEREOF MSN LABORATORIES PRIVATE LIMITED, R&D CENTER (IN) 2023-10-12 WO claimed
CN-116854642-A Preparation method of (S) -2-piperazine acetonitrile and hydrochloride thereof 重庆博腾制药科技股份有限公司 2023-10-10 CN claimed
WO-2022157633-A1 ENANTIOMERICALLY PURE DESGLYMIDODRINE AND PROCESS FOR PREPARATION THEREOF CADILA HEALTHCARE LIMITED (IN) 2022-07-28 WO claimed
CN-108289457-B Process for preparing antifungal compounds 迈科维亚医药公司 2021-08-06 CN claimed
CN-110935024-A Long acting compositions 合肥合源药业有限公司 2020-03-31 CN claimed
WO-2015063795-A2 NOVEL PROCESS FOR PREPARATION OF OPTICALLY PURE NOREPHEDRINE AND ITS DERIVATIVES LAURUS LABS PRIVATE LIMITED (IN) 2015-05-07 WO claimed
EP-1587801-A1 A PROCESS FOR PREPARING DULOXETINE AND INTERMEDIATES FOR USE THEREIN Cipla Ltd. (IN) 2005-10-26 EP claimed
WO-2004056795-A1 A PROCESS FOR PREPARING DULOXETINE AND INTERMEDIATES FOR USE THEREIN CIPLA LTD (IN) 2004-07-08 WO claimed
EP-0787115-B1 PROCESS FOR PRODUCING DERIVATIVES OF 4a,5,9,10,11,12,-HEXAHYDRO-6H-BENZOFURO[3a,3,2-ef][2]BENZAZEPINE SANOCHEMIA PHARMAZEUTIKA AG (AT) 2000-01-05 EP claimed
EP-0530335-B1 DIPHOSPHONIC ACID DERIVATES AS INTERMEDIATES FOR THE PRODUCTION OF DIPHOSPHINE LIGANDS HOFFMANN LA ROCHE (CH) 1996-08-14 EP claimed
EP-0530336-B1 CHIRAL PHOSPHINES HOFFMANN LA ROCHE (CH) 1996-03-06 EP claimed
EP-0575064-B1 Process for the resolution of 3-dimethylamino-2-methylpropiophenone (3-damp) MALLINCKRODT CHEMICAL INC (US) 1995-10-25 EP claimed
US-5326782-A Salts derived from 26-(dialkylaminoalkylsulphonyl)pristinamycin IIB RHONE-POULENC RORER S.A. (FR) 1994-07-05 US claimed
EP-0575064-A1 Process for the resolution of 3-dimethylamino-2-methylpropiophenone (3-damp) Mallinckrodt Chemical, Inc. (US) 1993-12-22 EP claimed
US-5227526-A Resolution of 3-dimethylamino-2-methylpropiophenone (3-DAMP) MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) 1993-07-13 US claimed
US-4072698-A OPTICALLY ACTIVE ACIDS WITH KETONE OR ALDEHYDE CATALYST THE UPJOHN COMPANY (US) 1978-02-07 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20250230160-A1 PROCESS FOR THE PREPARATION OF 4-((6BR,10AS)-3-METHYL-2,3,6B,9,10,10A-HEXAHYDRO-1H,7H-PYRIDO[3',4':4,5]PYRROLO[1,2,3-DE]QUINOXALIN-8-YL)-1-(4-FLUORO-PHENYL)-BUTAN-1-ONE AND INTERMEDIATES THEREOF CYP1B1, CYP4B1, CYP7A1 PPARG 4402/4885PPARA 4271/4885LMNA 1813/4885

“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.