SCHEMBL2739872

SCHEMBL2739872

COCOC1CC2CCC1(C)C2(C)C

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
KMT2A Q03164 5/20 0.47
KDM4E B2RXH2 2/20 0.47
LMNA P02545 5/20 0.44
HTT P42858 4/20 0.44
MEN1 O00255 3/20 0.43
MAPT P10636 4/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MAPK1 P28482 2/20 0.43
PLA2G1B P04054 1/20 0.43
RAD52 P43351 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43

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
SCHEMBL13103376 1.00 ALDH1A1 (0.52) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL19188985 0.84 ALDH1A1 (0.38) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL7688059 0.83 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL2739882 0.83 KMT2A (0.51) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL28263399 0.81 ALDH1A1 (0.55) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL75298 0.81 ALDH1A1 (0.55) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL2739884 0.80 KMT2A (0.52) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL10075953 0.80 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL5824224 0.80 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL147278 0.80 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170305848-A1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION TOKYO OHKA KOGYO CO., LTD. (JP) 2017-10-26 US disclosed
US-9732213-B2 Rheology modifier compositions and methods of use RHODIA OPERATIONS (FR) 2017-08-15 US disclosed
US-9434846-B2 Anti-settling and thickening compositions and methods for using same RHODIA OPERATIONS (FR) 2016-09-06 US disclosed
US-20160113856-A1 COMPOSITIONS WITH PH RESPONSIVE COPOLYMER CONTAINING MAEP AND/OR MAHP AND METHODS FOR USING SAME RHODIA OPERATIONS (FR) 2016-04-28 US disclosed
US-9090727-B2 Rheology modifier polymer RHODIA OPERATIONS (FR) 2015-07-28 US disclosed
US-9080135-B2 Compositions with freeze thaw stability RHODIA OPERATIONS (FR) 2015-07-14 US disclosed
US-20150183979-A1 RHEOLOGY MODIFIER COMPOSITIONS AND METHODS OF USE RHODIA OPERATIONS (FR) 2015-07-02 US disclosed
US-20140301966-A1 RHEOLOGY MODIFIER POLYMER SPECIALTY OPERATIONS FRANCE (FR) 2014-10-09 US disclosed
US-20140178325-A1 Anti-Settling and Thickening Compositions and Methods for Using Same RHODIA OPERATIONS (FR) 2014-06-26 US disclosed
US-8114949-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-02-14 US disclosed
US-8088875-B2 (Meth)acrylate, polymer and resist composition MITSUBISHI RAYON CO., LTD. (JP) 2012-01-03 US disclosed
US-20110223125-A1 COMPOSITIONS WITH FREEZE THAW STABILITY RHODIA OPERATIONS (FR) 2011-09-15 US disclosed
US-20100266952-A1 CYCLIC COMPOUND, PHOTORESIST BASE, PHOTORESIST COMPOSITION, MICROFABRICATION PROCESS, AND SEMICONDUCTOR DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-10-21 US disclosed
US-20100266952-A1 CYCLIC COMPOUND, PHOTORESIST BASE, PHOTORESIST COMPOSITION, MICROFABRICATION PROCESS, AND SEMICONDUCTOR DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-10-21 US disclosed
US-20090226851-A1 (METH)ACRYLATE, POLYMER AND RESIST COMPOSITION MITSUBISHI RAYON CO., LTD. (JP) 2009-09-10 US disclosed
US-20080003529-A1 (Meth)Acrylate, Polymer and Resist Composition MITSUBISHI RAYON CO., LTD. (JP) 2008-01-03 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 (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-20160113856-A1 COMPOSITIONS WITH PH RESPONSIVE COPOLYMER CONTAINING MAEP AND/OR MAHP AND METHODS FOR USING SAME PRUNE1, PHLPP1, PHLPP2 ALDH1A1 2142/4885KMT2A 428/4885KDM4E 162/4885
US-20170305848-A1 SULFONIUM SALT, PHOTOACID GENERATOR, AND PHOTOSENSITIVE COMPOSITION ARSA, SPIN1, ASIC1 ALDH1A1 2376/4885KMT2A 1881/4885KDM4E 3853/4885
US-20110223125-A1 COMPOSITIONS WITH FREEZE THAW STABILITY C9, PUF60, BCL2L10 ALDH1A1 1380/4885KMT2A 4329/4885KDM4E 3189/4885
US-20140301966-A1 RHEOLOGY MODIFIER POLYMER C1R, PUF60, C9 ALDH1A1 3739/4885KMT2A 1415/4885KDM4E 1849/4885
US-20100266952-A1 CYCLIC COMPOUND, PHOTORESIST BASE, PHOTORESIST COMPOSITION, MICROFABRICATION PROCESS, AND SEMICONDUCTOR DEVICE C1S, CCNL2, CCNT1 ALDH1A1 2673/4885KMT2A 737/4885KDM4E 1401/4885
US-20140178325-A1 Anti-Settling and Thickening Compositions and Methods for Using Same GRN, CAPG, C5 ALDH1A1 4532/4885KMT2A 3218/4885KDM4E 1076/4885

“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.