SCHEMBL248670

SCHEMBL248670

Cc1ccccc1C(=O)C(O)(C(=O)O)C(O)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
MYC P01106 1/20 0.40
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
KMT2A Q03164 2/20 0.36
FFAR1 O14842 1/20 0.36
ADRB2 P07550 1/20 0.36
ADRB1 P08588 1/20 0.36
ADRB3 P13945 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTT P42858 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL3644471 1.00 HPGD (0.40) HPGDMYCERCC5FEN1KMT2A
SCHEMBL1443195 1.00 HPGD (0.40) HPGDMYCERCC5FEN1KMT2A
SCHEMBL29869399 1.00 HPGD (0.40) HPGDMYCERCC5FEN1KMT2A
SCHEMBL22639010 0.88 MYC (0.38) HPGDMYCKMT2AKDM4EALDH1A1
SCHEMBL30122149 0.88 MYC (0.38) HPGDMYCKMT2AKDM4EALDH1A1
Water SCHEMBL23070689 0.86 MYC (0.37) HPGDMYCKMT2AKDM4EALDH1A1
SCHEMBL28127994 0.81 ALDH1A1 (0.47) HPGDERCC5FEN1ADRB2ADRB1
SCHEMBL28195204 0.81 CES2 (0.44) HPGDERCC5FEN1KMT2AADRB2
SCHEMBL7181728 0.80 HPGD (0.43) HPGDKMT2AKDM4EALDH1A1HSD17B10
SCHEMBL2722029 0.80 HPGD (0.43) HPGDKMT2AKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3419974-B1 PROCESS FOR THE SEPARATION OF ENANTIOMERS OF PIPERAZINE DERIVATIVES ASCENEURON SA (CH) 2021-05-05 EP claimed
CN-109462982-A Dimension Doreptide under physiological condition with poor solubility is for treating acromegalia, acromegalia cancer, SST-R5 expression type tumour, type-2 diabetes mellitus, hyperglycemia and hormone related neoplasms 斯特朗布里奇都柏林有限公司 2019-03-12 CN claimed
EP-3286168-A1 A SOLID FORM OF APREMILAST AND A PROCESS FOR PREPARING THE SAME Zentiva K.S. (CZ) 2018-02-28 EP claimed
WO-2016169533-A1 A SOLID FORM OF APREMILAST AND A PROCESS FOR PREPARING THE SAME ZENTIVA, K.S. (CZ) 2016-10-27 WO claimed
EP-2588441-A2 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR Actavis Group Ptc Ehf (IS) 2013-05-08 EP claimed
WO-2012001531-A2 NOVEL PROCESSES FOR THE PREPARATION OF PHENYLCYCLOPROPYLAMINE DERIVATIVES AND USE THEREOF FOR PREPARING TICAGRELOR ACTAVIS GROUP PTC EHF (IS) 2012-01-05 WO claimed
EP-2118061-A2 PROCESS OF ENANTIOMERIC RESOLUTION OF D,L-( + )-THREO-METHYLPHENIDATE Archimica, Inc. (US) 2009-11-18 EP claimed
WO-2008125914-A2 PROCESS OF ENANTIOMERIC RESOLUTION OF D,L-( + )-THREO-METHYLPHENIDATE ARCHIMICA, INC. (US) 2008-10-23 WO claimed
EP-1802628-A1 CRYSTALLINE FORMS AND PROCESS FOR PREPARING SPIRO-HYDANTOIN COMPOUNDS Bristol-Myers Squibb Company (US) 2007-07-04 EP claimed
WO-2006039639-A1 CRYSTALLINE FORMS AND PROCESS FOR PREPARING SPIRO-HYDANTOIN COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2006-04-13 WO claimed
WO-2004065375-A1 PROCESSES FOR THE PREPARATION OF ESCITALOPRAM AND ITS PRECURSOR NATCO PHARMA LIMITED (IN) 2004-08-05 WO claimed
EP-0759904-A1 PROCESS AND DIASTEREOMERIC SALTS USEFUL FOR THE OPTICAL RESOLUTION OF RACEMIC ALPHA-[4-(1,1-DIMETHYLETHYL)PHENYL]-4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINEBUTANOL AND DERIVATIVE COMPOUNDS MERRELL PHARMACEUTICALS INC. (US) 1997-03-05 EP claimed
WO-1995031436-A1 PROCESS AND DIASTEREOMERIC SALTS USEFUL FOR THE OPTICAL RESOLUTION OF RACEMIC α-[4-(1,1-DIMETHYLETHYL)PHENYL]-4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINEBUTANOL AND DERIVATIVE COMPOUNDS MERRELL PHARMACEUTICALS INC. (US) 1995-11-23 WO claimed
WO-1992014729-A1 ANTIVIRAL 1,3-DIOXOLANE NUCLEOSIDES AND SYNTHESIS THEREOF EMORY UNIVERSITY (US) 1992-09-03 WO claimed
JP-10226678-A None JP disclosed
CN-115054600-B Aromatic sulfonamide derivatives 拜耳制药股份公司 2024-06-14 CN disclosed
EP-4259633-A1 PROCESSES FOR THE PREPARATION OF ZANUBRUTINIB AND INTERMEDIATES THEREOF Teva Pharmaceuticals International GmbH (CH) 2023-10-18 EP disclosed
WO-1995031436-A1 PROCESS AND DIASTEREOMERIC SALTS USEFUL FOR THE OPTICAL RESOLUTION OF RACEMIC α-[4-(1,1-DIMETHYLETHYL)PHENYL]-4-(HYDROXYDIPHENYLMETHYL)-1-PIPERIDINEBUTANOL AND DERIVATIVE COMPOUNDS MERRELL PHARMACEUTICALS INC. (US) 1995-11-23 WO disclosed
EP-0575482-A1 ANTIVIRAL ACTIVITY AND RESOLUTION OF 2-HYDROXYMETHYL-5-(5-FLUOROCYTOSIN-1-YL)-1,3-OXATHIOLANE EMORY UNIVERSITY (US) 1993-12-29 EP disclosed
WO-1992014743-A2 ANTIVIRAL ACTIVITY AND RESOLUTION OF 2-HYDROXYMETHYL-5-(5-FLUOROCYTOSIN-1-YL)-1,3-OXATHIOLANE EMORY UNIVERSITY (US) 1992-09-03 WO disclosed