SCHEMBL2951352

SCHEMBL2951352

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

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.42
PKM P14618 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
SLC7A5 Q01650 1/20 0.42
MME P08473 3/20 0.42
HPGD P15428 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP1A2 P05177 1/20 0.41
CPA1 P15085 3/20 0.40
TAAR1 Q96RJ0 1/20 0.40
CPB1 P15086 1/20 0.40
CPA3 P15088 1/20 0.40
CPB2 Q96IY4 1/20 0.40
AKR1C3 P42330 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CTRB1 P17538 2/20 0.39
ALDH1A1 P00352 1/20 0.39

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
Methacrylic Acid SCHEMBL3739485 0.97 MME (0.40) ALPIPKMPTGS1XIAPSLC7A5
Toluene SCHEMBL8474940 0.94 MME (0.38) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL15639721 0.82 TBXAS1 (0.41) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL3072863 0.82 THRB (0.48) MMEALDH1A1
SCHEMBL6845371 0.80 CYP1A2 (0.46) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL2912969 0.79 SLC15A1 (0.53) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL963649 0.78 CYP3A4 (0.32) MMEHPGDCYP2C9
SCHEMBL12193980 0.77 NPC1 (0.47) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL28474427 0.77 NPC1 (0.47) ALPIPKMPTGS1XIAPSLC7A5
Methacrylic Acid SCHEMBL2287000 0.77 CNR2 (0.43) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2756044-B1 INK COMPOSITION FOR CONTINUOUS INKJET PRINTER EASTMAN KODAK CO (US) 2018-05-30 EP disclosed
US-9365515-B2 Oxime ester photoinitiators BASF SE (DE) 2016-06-14 US disclosed
US-9068093-B2 Surface modification of carbon black EASTMAN KODAK COMPANY (US) 2015-06-30 US disclosed
US-9051397-B2 Oxime ester BASF SE (DE) 2015-06-09 US disclosed
US-9010909-B2 Continuous inkjet printing method EASTMAN KODAK COMPANY (US) 2015-04-21 US disclosed
US-20150056554-A1 Oxime Ester Photoinitiators CIBA CORPORATION (US) 2015-02-26 US disclosed
US-8911921-B2 Oxime ester photoinitiators CIBA CORPORATION (US) 2014-12-16 US disclosed
EP-2756044-A1 INK COMPOSITION FOR CONTINUOUS INKJET PRINTER Eastman Kodak Company (US) 2014-07-23 EP disclosed
US-8784549-B2 Ink set for continuous inkjet printing EASTMAN KODAK COMPANY (US) 2014-07-22 US disclosed
US-20140000478-A1 SURFACE MODIFICATION OF CARBON BLACK BANK OF AMERICA, N.A., AS AGENT 2014-01-02 US disclosed
US-20040170924-A1 Oxime ester photoiniators having a combined structure CIBA CORPORATION 2004-09-02 US disclosed
US-6596445-B1 Initiators for photopolymerization of radically polymerizable compounds CIBA SPECIALTY CHEMICALS CORPORATION 2003-07-22 US disclosed
EP-0851011-B1 Ink jet inks containing emulsion polymer additives stabilized with structured polymers DU PONT (US) 2002-05-22 EP disclosed
US-6020400-A BLOCK AND GRAFT POLYMER BLENDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-02-01 US disclosed
EP-0700909-B1 Photosensitive bis(halomethyloxadiazole) compound and photosensitive transfer sheet using the same FUJI PHOTO FILM CO LTD (JP) 1998-12-30 EP disclosed
EP-0851011-A2 Ink jet inks containing emulsion polymer additives stabilized with structured polymers E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-07-01 EP disclosed
US-5652082-A PHOTOPOLYMERIZATION INITIATOR FOR TRANSFER SHEETS, PRINTING PLATES, PHOTORESISTS, COLOR PROOFS FUJI PHOTO FILM CO., LTD. (JP) 1997-07-29 US disclosed
US-5576441-A STORAGE STABILITY; DISCOLORATION INHIBITION FUJI PHOTO FILM CO., LTD. (JP) 1996-11-19 US disclosed
EP-0700909-A1 Photosensitive bis(halomethyloxadiazole) compound and photosensitive transfer sheet using the same FUJI PHOTO FILM CO., LTD. (JP) 1996-03-13 EP disclosed
US-5200292-A Light-sensitive composition consisting essentially of, in admixture a nonionic aromatic diazo compound and a cationic dye/borate anion complex FUJI PHOTO FILM CO., LTD. (JP) 1993-04-06 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 (2 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-20140000478-A1 SURFACE MODIFICATION OF CARBON BLACK IK, TYR, CD99 ALPI 3637/4885PKM 1312/4885PTGS1 3811/4885
US-20150056554-A1 Oxime Ester Photoinitiators CBR3, CCNE2, CBR1 ALPI 4593/4885PKM 1206/4885PTGS1 871/4885

“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.