SCHEMBL9755832

SCHEMBL9755832

CC(C)(c1ccccc1)C(CC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.48
HIF1A Q16665 1/20 0.48
KIF11 P52732 7/20 0.42
CPA1 P15085 2/20 0.42
CPB1 P15086 1/20 0.42
CPA3 P15088 1/20 0.42
CPB2 Q96IY4 1/20 0.42
MAPT P10636 2/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HDAC3 O15379 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC7 Q8WUI4 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC10 Q969S8 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 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
SCHEMBL9971684 0.87 CYP2C19 (0.43) CYP2C19HIF1AKIF11MAPTKMT2A
SCHEMBL4377967 0.83 CYP2C19 (0.46) CYP2C19HIF1AKIF11MAPTKMT2A
SCHEMBL4378855 0.80 CYP1A2 (0.50) CYP2C19HIF1ACPA1CPB1CPA3
SCHEMBL28437088 0.79 CYP2C19 (0.50) CYP2C19HIF1AKIF11CPA1CPB1
SCHEMBL4375323 0.77 CYP2C19 (0.49) CYP2C19HIF1AKIF11MAPTKMT2A
SCHEMBL8909445 0.76 CYP2C19 (0.40) CYP2C19HIF1AKIF11MAPTKMT2A
SCHEMBL8909447 0.76 CYP2C19 (0.40) CYP2C19HIF1AKIF11MAPTKMT2A
SCHEMBL5133749 0.76 KIF11 (0.46) CYP2C19HIF1AKIF11KMT2A
SCHEMBL15362206 0.75 CPA1 (0.40) CYP2C19HIF1AKIF11CPA1CPB1
SCHEMBL7288198 0.74 CYP1A2 (0.48) CYP2C19HIF1AKIF11MAPTKMT2A

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4840875-A Desensitizing gum for lithographic printing plate comprising a polybasic and monoester of polysaccharide FUJI PHOTO FILM CO., LTD. (JP) 1989-06-20 US claimed
US-4698411-A Polyester resins PHILLIPS PETROLEUM COMPANY (US) 1987-10-06 US claimed
CN-103370298-B method of making indeno-fused naphthol materials TRANSITIONS OPTICAL, INC. (US) 2016-05-25 CN disclosed
US-9073838-B2 Method of making indeno-fused naphthol materials TRANSITIONS OPTICAL, INC. (US) 2015-07-07 US disclosed
US-9073838-B2 Method of making indeno-fused naphthol materials TRANSITIONS OPTICAL, INC. (US) 2015-07-07 US disclosed
EP-2651914-B1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL INC (US) 2015-05-13 EP disclosed
US-8920928-B2 Photochromic compounds and compositions TRANSITIONS OPTICAL, INC. (US) 2014-12-30 US disclosed
US-20140364618-A1 Method of Making Indeno-Fused Naphthol Materials TRANSITIONS OPTICALS, INC. (US) 2014-12-11 US disclosed
US-20140364618-A1 Method of Making Indeno-Fused Naphthol Materials TRANSITIONS OPTICALS, INC. (US) 2014-12-11 US disclosed
US-8765978-B2 Method of making indeno-fused naphthol materials TRANSITIONS OPTICAL, INC. (US) 2014-07-01 US disclosed
US-8765978-B2 Method of making indeno-fused naphthol materials TRANSITIONS OPTICAL, INC. (US) 2014-07-01 US disclosed
EP-2651914-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS Transitions Optical, Inc. (US) 2013-10-23 EP disclosed
US-20120157696-A1 METHOD OF MAKING INDENO-FUSED NAPHTHOL MATERIALS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120157696-A1 METHOD OF MAKING INDENO-FUSED NAPHTHOL MATERIALS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 US disclosed
WO-2012082999-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 WO disclosed
WO-2012082837-A1 METHOD OF MAKING INDENO-FUSED NAPHTHOL MATERIALS TRANSITIONS OPTICAL, INC. (US) 2012-06-21 WO disclosed
WO-1991005763-A1 DIPEPTIDE-ANALOG-BASED METALLOENDOPEPTIDASE INHIBITORS AND METHODS OF USING SAME THE SALK INSTITUTE BIOTECHNOLOGY/INDUSTRIAL ASSOCIATES, INC. (US) 1991-05-02 WO disclosed
US-4840875-A Desensitizing gum for lithographic printing plate comprising a polybasic and monoester of polysaccharide FUJI PHOTO FILM CO., LTD. (JP) 1989-06-20 US disclosed
US-4698411-A Polyester resins PHILLIPS PETROLEUM COMPANY (US) 1987-10-06 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 (3 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-20140364618-A1 Method of Making Indeno-Fused Naphthol Materials IDH3A, NQO1, IDH3B CYP2C19 209/4885HIF1A 1130/4885KIF11 3356/4885
US-20120157696-A1 METHOD OF MAKING INDENO-FUSED NAPHTHOL MATERIALS NQO1, IDH3A, IDH2 CYP2C19 322/4885HIF1A 1735/4885KIF11 2977/4885
US-20120156508-A1 PHOTOCHROMIC COMPOUNDS AND COMPOSITIONS CRY2, CRY1, IPO4 CYP2C19 469/4885HIF1A 3979/4885KIF11 2348/4885

“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.