SCHEMBL883357

SCHEMBL883357

CC(C)C(Cc1ccccc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.63
SLC1A2 P43004 1/20 0.63
SLC1A1 P43005 1/20 0.63
CYP1A2 P05177 1/20 0.57
ACE P12821 7/20 0.54
ALPI P09923 1/20 0.53
PKM P14618 1/20 0.53
PTGS1 P23219 1/20 0.53
XIAP P98170 1/20 0.53
SLC7A5 Q01650 1/20 0.53
TRPA1 O75762 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
CPA1 P15085 2/20 0.50
CPA3 P15088 2/20 0.50
FOLH1 Q04609 1/20 0.50
CPB1 P15086 1/20 0.50
CPB2 Q96IY4 1/20 0.50
NR4A2 P43354 1/20 0.49

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
SCHEMBL5511480 1.00 SLC1A3 (0.63) SLC1A3SLC1A2SLC1A1CYP1A2ACE
(2R,3R)-2,3-Dibenzylsuccinic Acid SCHEMBL2919214 0.87 SLC1A3 (0.73) SLC1A3SLC1A2SLC1A1CYP1A2ACE
(2R,3R)-2,3-Dibenzylsuccinic Acid SCHEMBL305323 0.87 SLC1A3 (0.73) SLC1A3SLC1A2SLC1A1CYP1A2ACE
(2R,3R)-2,3-Dibenzylsuccinic Acid SCHEMBL4755513 0.87 SLC1A3 (0.73) SLC1A3SLC1A2SLC1A1CYP1A2ACE
(2R,3R)-2,3-Dibenzylsuccinic Acid SCHEMBL7289849 0.87 SLC1A3 (0.73) SLC1A3SLC1A2SLC1A1CYP1A2ACE
SCHEMBL24252143 0.86 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1CYP1A2ACE
SCHEMBL5708390 0.86 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1CYP1A2ACE
SCHEMBL19647227 0.86 ALPI (0.52) SLC1A3SLC1A2SLC1A1CYP1A2ACE
SCHEMBL7415792 0.86 SLC1A3 (0.61) SLC1A3SLC1A2SLC1A1CYP1A2ACE
SCHEMBL12768183 0.86 ALPI (0.52) SLC1A3SLC1A2SLC1A1CYP1A2ACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115873020-A RAS inhibitors 锐新医药公司 2023-03-31 CN disclosed
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES GERO PTE. LTD. (SG) 2023-02-16 US disclosed
US-11206835-B2 Air purification composition with antiviral and bactericidal functions Guorun Biotechnology (Shenzhen) Co., Ltd. (CN) 2021-12-28 US disclosed
WO-2021195183-A1 COMPOSITIONS AND METHODS FOR INHIBITING PROTEIN EMBRYONIC ECTODERM DEVELOPMENT ACTIVITY AND TREATING DISEASE EXO THERAPEUTICS, INC. (US) 2021-09-30 WO disclosed
EP-3327027-B9 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER (US) 2021-07-07 EP disclosed
EP-3327027-B1 CYTOTOXIC PEPTIDES AND ANTIBODY DRUG CONJUGATES THEREOF PFIZER (US) 2021-01-06 EP disclosed
US-20200329717-A1 NOVEL AIR PURIFICATION COMPOSITION WITH ANTIVIRAL AND BACTERICIDAL FUNCTIONS Guorun Biotechnology (Shenzhen) Co., Ltd. (CN) 2020-10-22 US disclosed
EP-3650105-A1 NOVEL AIR PURIFICATION COMPOSITION HAVING ANTIVIRAL AND BACTERICIDAL FUNCTIONS Wang, Jingning (CN) 2020-05-13 EP disclosed
US-20200033314-A1 SENSOR DYES FOR REAL-TIME SENSING OF METAL IONS IN AQUEOUS ENVIRONMENTS ADVANCED CHEMICAL SYSTEMS, INC. 2020-01-30 US disclosed
WO-2020015053-A1 NOVEL AIR PURIFICATION COMPOSITION HAVING ANTIVIRAL AND BACTERICIDAL FUNCTIONS 王婧宁 2020-01-23 WO disclosed
US-20130079319-A1 CEPHEM COMPOUND HAVING PSEUDO-CATECHOL GROUP SHIONOGI & CO., LTD. (JP) 2013-03-28 US disclosed
US-RE43298-E1 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2012-04-03 US disclosed
WO-2012038813-A1 BUPRENORPHINE ANALOGS PURDUE PHARMA L.P. (US) 2012-03-29 WO disclosed
US-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2011-05-19 US disclosed
US-20100137294-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING INVERTEBRATE PESTS GENETIC TECHNOLOGIES LIMITED (AU) 2010-06-03 US disclosed
US-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-27 US disclosed
US-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-27 US disclosed
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-20 US disclosed
WO-2003062265-A2 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2003-07-31 WO disclosed
EP-0698010-A1 N-ACYL SULFAMIC ACID ESTERS (OR THIOESTERS), N-ACYL SULFONAMIDES, AND N-SULFONYL CARBAMIC ACID ESTERS (OR THIOESTERS) AS HYPERCHOLESTEROLEMIC AGENTS WARNER-LAMBERT COMPANY (US) 1996-02-28 EP 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 (6 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-20130079319-A1 CEPHEM COMPOUND HAVING PSEUDO-CATECHOL GROUP CENPE, CCNE2, CEP170 SLC1A3 1131/4885SLC1A2 915/4885SLC1A1 847/4885
US-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 SLC1A3 4721/4885SLC1A2 4764/4885SLC1A1 4759/4885
US-20230047816-A1 PFKFB3 INHIBITORS AND THEIR USES PFKFB3, PFKFB4, PFKFB1 SLC1A3 118/4885SLC1A2 647/4885SLC1A1 265/4885
US-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS HPN, TMPRSS15, VIP SLC1A3 4240/4885SLC1A2 4759/4885SLC1A1 4345/4885
US-20100137294-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR CONTROLLING INVERTEBRATE PESTS PPP1R10, TASP1, PPP5C SLC1A3 3386/4885SLC1A2 3416/4885SLC1A1 3129/4885
US-20070219206-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 SLC1A3 4721/4885SLC1A2 4764/4885SLC1A1 4759/4885

“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.