SCHEMBL9980122

SCHEMBL9980122

CCc1cc2sc(CC)cc2s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.42
HSD17B10 Q99714 1/20 0.42
SELE P16581 7/20 0.38
VCAM1 P19320 7/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ICAM1 P05362 6/20 0.36
CYP1A2 P05177 3/20 0.35
CYP2C9 P11712 3/20 0.35
CA2 P00918 2/20 0.35
TMIGD3 P0DMS9 1/20 0.35
ADORA1 P30542 1/20 0.35
DAO P14920 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
ADRB2 P07550 1/20 0.31
CYP2A6 P11509 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL16004512 0.87 MAPK1 (0.37) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL2756710 0.82 MAPK1 (0.34) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL23794121 0.82 MAPK1 (0.38) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL12651908 0.80 CYP1A2 (0.36) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL9980132 0.80 MAPK1 (0.39) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL21608640 0.80 MAPK1 (0.37) MAPK1HSD17B10CA2
SCHEMBL13407339 0.80 MAPK1 (0.33) MAPK1HSD17B10SELEVCAM1GAA
SCHEMBL14985734 0.78 MAPK1 (0.33) MAPK1HSD17B10
SCHEMBL11892113 0.78 GPR35 (0.42) MAPK1HSD17B10SELEVCAM1ALDH1A1
SCHEMBL2756691 0.76 IKBKB (0.41) SELEVCAM1GAANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9567425-B2 Periodic structured organic films XEROX CORPORATION (US) 2017-02-14 US disclosed
US-20170022338-A1 PERIODIC STRUCTURED ORGANIC FILMS XEROX CORPORATION 2017-01-26 US disclosed
US-20160259256-A1 IMAGING MEMBERS COMPRISING CAPPED STRUCTURED ORGANIC FILM COMPOSITIONS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2016-09-08 US disclosed
US-9097995-B2 Electronic devices comprising structured organic films XEROX CORPORATION (US) 2015-08-04 US disclosed
US-8859171-B2 Charge transport particles XEROX CORPORATION (US) 2014-10-14 US disclosed
US-8759473-B2 High mobility periodic structured organic films XEROX CORPORATION (US) 2014-06-24 US disclosed
WO-2014026244-A1 PHOTOACTIVE OPTOELECTRONIC AND TRANSISTOR DEVICES COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-02-20 WO disclosed
US-20130137033-A1 PROCESS FOR PREPARING STRUCTURED ORGANIC FILMS (SOFS) VIA A PRE-SOF XEROX CORPORATION (US) 2013-05-30 US disclosed
US-8394495-B2 Composite structured organic films XEROX CORPORATION (US) 2013-03-12 US disclosed
US-8389060-B2 Process for preparing structured organic films (SOFs) via a pre-SOF XEROX CORPORATION (US) 2013-03-05 US disclosed
US-8093347-B2 Structured organic films XEROX CORPORATION (US) 2012-01-10 US disclosed
US-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 US disclosed
US-20110217642-A1 CHARGE TRANSPORT PARTICLES XEROX CORPORATION (US) 2011-09-08 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 US disclosed
US-20100227071-A1 PROCESS FOR PREPARING STRUCTURED ORGANIC FILMS (SOFS) VIA A PRE-SOF XEROX CORPORATION (US) 2010-09-09 US disclosed
US-20100227157-A1 COMPOSITE STRUCTURED ORGANIC FILMS XEROX CORPORATION (US) 2010-09-09 US disclosed
US-20100227998-A1 STRUCTURED ORGANIC FILMS XEROX CORPORATION (US) 2010-09-09 US disclosed
US-20100227081-A1 MIXED SOLVENT PROCESS FOR PREPARING STRUCTURED ORGANIC FILMS XEROX CORPORATION (US) 2010-09-09 US disclosed
US-7718760-B2 π-Conjugated polymer and manufacturing method thereof RICOH COMPANY, LTD. (JP) 2010-05-18 US disclosed
US-7611823-B1 Photosensitive polymeric material for WORM optical data storage with two-photon fluorescent readout UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-11-03 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 (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-20100310512-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 MAPK1 3854/4885HSD17B10 3314/4885SELE 3219/4885
US-20100227998-A1 STRUCTURED ORGANIC FILMS VIM, PUF60, EPCAM MAPK1 4389/4885HSD17B10 3909/4885SELE 653/4885

“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.