SCHEMBL1123596

SCHEMBL1123596

CCCCCCCCCCCCCCCCCCOS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.49
RECQL P46063 2/20 0.49
MAPK1 P28482 2/20 0.49
GLA P06280 1/20 0.49
HPGD P15428 1/20 0.49
EPHX2 P34913 1/20 0.49
BLM P54132 1/20 0.49
CA2 P00918 11/20 0.46
CA1 P00915 10/20 0.46
CA9 Q16790 9/20 0.46
CA12 O43570 4/20 0.46
CA7 P43166 4/20 0.46
CA14 Q9ULX7 3/20 0.46
CA3 P07451 2/20 0.46
CA4 P22748 2/20 0.46
CA6 P23280 2/20 0.46
CA5A P35218 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
CNR2 P34972 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL8921158 1.00 TSHR (0.49) TSHRRECQLMAPK1GLAHPGD
SCHEMBL8920377 1.00 TSHR (0.49) TSHRRECQLMAPK1GLAHPGD
SCHEMBL8915955 1.00 TSHR (0.49) TSHRRECQLMAPK1GLAHPGD
SCHEMBL8926435 1.00 TSHR (0.49) TSHRRECQLMAPK1GLAHPGD
SCHEMBL10870886 1.00 TSHR (0.49) TSHRRECQLMAPK1GLAHPGD
SCHEMBL4192257 0.98 RECQL (0.46) TSHRRECQLMAPK1GLAHPGD
SCHEMBL27649743 0.93 CA2 (0.46) TSHRRECQLMAPK1GLAHPGD
SCHEMBL27995614 0.91 RECQL (0.57) TSHRRECQLMAPK1GLAHPGD
SCHEMBL27520719 0.91 RECQL (0.57) TSHRRECQLMAPK1GLAHPGD
SCHEMBL27550478 0.90 RECQL (0.55) TSHRRECQLMAPK1GLAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1712601-B1 Phase change inks XEROX CORP (US) 2010-07-28 EP claimed
US-6461417-B1 Ink compositions XEROX CORPORATION 2002-10-08 US claimed
US-6398857-B1 ACCUSTIC PIEZOELECTRIC; HOT MELT INK JET PRINTING; BENZOIC ACID VEHICLE; ALKYL OR PHENYL CARBOXYLIC ACID VISCOSITY MODIFIER; RETAINS DESIRED HARDNESS XEROX CORPORATION 2002-06-04 US claimed
US-6187083-B1 INK COMPOSITION COMPRISING SELECTED INK VEHICLE, AMIDE VISCOSITY MODIFIER, CONDUCTIVE SULFONATE SALT ALL HAVING MELTING POINTS WITHIN SPECIFIED RANGE, COLORANT, OPTIONAL ANTIOXIDANT AND ULTRAVIOLET ABSORBER XEROX CORPORATION 2001-02-13 US claimed
US-9597416-B2 Fluorescent membrane intercalating probes and methods for their use PHANOS TECHNOLOGIES, INC. (US) 2017-03-21 US disclosed
US-20150044143-A1 FLUORESCENT MEMBRANE INTERCALATING PROBES AND METHODS FOR THEIR USE PHANOS TECHNOLOGIES, INC. (US) 2015-02-12 US disclosed
US-8894976-B2 Fluorescent membrane intercalating probes and methods for their use PHANOS TECHNOLOGIES, INC. (US) 2014-11-25 US disclosed
EP-1985672-B1 Phase Change Ink Compositions XEROX CORP (US) 2011-02-09 EP disclosed
US-7811370-B2 Phase change ink compositions XEROX CORPORATION (US) 2010-10-12 US disclosed
EP-1712601-B1 Phase change inks XEROX CORP (US) 2010-07-28 EP disclosed
EP-1535974-B1 Processes for preparing phase change inks XEROX CORP (US) 2010-03-31 EP disclosed
US-20090304598-A1 FLUORESCENT MEMBRANE INTERCALATING PROBES AND METHODS FOR THEIR USE PHANOS TECHNOLOGIES, INC. (US) 2009-12-10 US disclosed
US-5241027-A MACROMOLECULAR SPIROPYRAN COMPOUNDS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1993-08-31 US disclosed
US-5236958-A BENZOSELENAZOLINO-VINYLSPIROPYRAN COMPOUND OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1993-08-17 US disclosed
EP-0470264-A1 BENZOSELENAZOLINE-SPIRO-VINYLPYRAN COMPOUND AND POLYMER COMPRISING THE SAME OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-02-12 EP disclosed
EP-0466938-A1 HIGH-MOLECULAR SPIROPYRAN COMPOUND OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-01-22 EP disclosed
US-5008405-A Selective etherification TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-04-16 US disclosed
EP-0379968-A2 Selective etherification Takeda Chemical Industries, Ltd. (JP) 1990-08-01 EP disclosed
US-4804613-A PHOTOPOLYMERIZABLE MONOMER; ERASABLE CANON KABUSHIKI KAISHA (JP) 1989-02-14 US disclosed
US-4766047-A USING PHOTO POLYMERIZABLE MONOMER WITH HYDROPHOBIC AND HYDROPHILIC GROUPS AND UNSATURATED BOND CANON KABUSHIKI KAISHA (JP) 1988-08-23 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-20090304598-A1 FLUORESCENT MEMBRANE INTERCALATING PROBES AND METHODS FOR THEIR USE TIMM44, SLC47A2, TIMM50 TSHR 3098/4885RECQL 579/4885MAPK1 4760/4885
US-20150044143-A1 FLUORESCENT MEMBRANE INTERCALATING PROBES AND METHODS FOR THEIR USE TIMM44, SLC47A2, TIMM50 TSHR 3098/4885RECQL 579/4885MAPK1 4760/4885

“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.