SCHEMBL821232

SCHEMBL821232

Cc1cc(CC(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.68
CYP2C9 P11712 5/20 0.66
CYP2C19 P33261 5/20 0.66
SMN1; SMN2 Q16637 4/20 0.66
HIF1A Q16665 4/20 0.66
CA2 P00918 3/20 0.59
ALDH1A1 P00352 3/20 0.59
POLB P06746 1/20 0.59
TYR P14679 1/20 0.59
CYP2D6 P10635 2/20 0.58
HSD17B10 Q99714 1/20 0.58
CYP1A2 P05177 3/20 0.44
GABRA1 P14867 2/20 0.41
GABRB2 P47870 2/20 0.41
CA1 P00915 2/20 0.41
HMGCR P04035 1/20 0.38
TP53 P04637 2/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
LMNA P02545 2/20 0.37

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
SCHEMBL10015719 0.94 CYP2C9 (0.78) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL11799692 0.86 HSPA5 (0.50) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL12443051 0.86 HSPA5 (0.51) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL6906650 0.85 HSPA5 (0.72) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL17500061 0.85 HSPA5 (0.62) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL536637 0.82 GABRA1 (0.58) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL11799689 0.82 HSPA5 (0.46) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL8756022 0.82 ALDH1A1 (0.46) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
Butylated Hydroxytoluene SCHEMBL127920 0.81 SMN1; SMN2 (0.69) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A
SCHEMBL29558774 0.81 HSPA5 (0.78) HSPA5CYP2C9CYP2C19SMN1; SMN2HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140234763-A1 IMAGE FORMING APPARATUS AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2014-08-21 US disclosed
US-8674017-B2 (Poly)carbonate polyol and carboxyl group-containing polyurethane obtained from the (poly)carbonate polyol SHOWA DENKO K.K. (JP) 2014-03-18 US disclosed
US-8669306-B2 Curable composition SHOWA DENKO K.K. (JP) 2014-03-11 US disclosed
US-8486595-B2 Image bearing member, image forming apparatus, and process cartridge RICOH COMPANY, LTD. (JP) 2013-07-16 US disclosed
US-20130178578-A1 MOISTURE-PROOF INSULATING MATERIAL SHOWA DENKO K.K. (JP) 2013-07-11 US disclosed
US-20120321348-A1 IMAGE BEARING DRUM, IMAGE FORMING APPARATUS, IMAGE FORMING METHOD, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2012-12-20 US disclosed
US-20120305295-A1 THERMOSETTING COMPOSITION SHOWA DENKO K.K. (JP) 2012-12-06 US disclosed
US-8273513-B2 Image forming apparatus, process cartridge, and image bearing member RICOH COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-8173343-B2 Electrophotographic photoconductor, image forming apparatus using the same, and process cartridge RICOH COMPANY, LTD. (JP) 2012-05-08 US disclosed
US-20110272182-A1 CARBOXYL GROUP-CONTAINING POLYURETHANE SHOWA DENKO K.K. (JP) 2011-11-10 US disclosed
US-20110272183-A1 (POLY)CARBONATE POLYOL AND CARBOXYL GROUP-CONTAINING POLYURETHANE OBTAINED FROM THE (POLY)CARBONATE POLYOL SHOWA DENKO K.K. (JP) 2011-11-10 US disclosed
US-20110253426-A1 CURABLE COMPOSITION SHOWA DENKO K.K. (JP) 2011-10-20 US disclosed
US-20110177338-A1 CARBON BLACK KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2011-07-21 US disclosed
US-7951310-B2 Nanophase carbon black grafted with organic compound in situ EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2011-05-31 US disclosed
US-20110059393-A1 IMAGE BEARING MEMBER, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2011-03-10 US disclosed
US-20100330475-A1 IMAGE FORMING APPARATUS, PROCESS CARTRIDGE, AND IMAGE BEARING MEMBER RICOH COMPANY LIMITED (JP) 2010-12-30 US disclosed
US-20100015538-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, IMAGE FORMING APPARATUS USING THE SAME, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2010-01-21 US disclosed
US-20090085013-A1 Composition Containing Carbon Black, Composition for Coloring and Conductive Composition KONICA MINOLTA BUSINESS TECHNOLOGIES, INC., (JP) 2009-04-02 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 (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-20110272183-A1 (POLY)CARBONATE POLYOL AND CARBOXYL GROUP-CONTAINING POLYURETHANE OBTAINED FROM THE (POLY)CARBONATE POLYOL PUF60, PARG, PIK3C2G HSPA5 4357/4885CYP2C9 1807/4885CYP2C19 1971/4885

“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.