SCHEMBL699875

SCHEMBL699875

Clc1cccc(C=Cc2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHAT P28329 1/20 0.66
RELA Q04206 2/20 0.63
MAOB P27338 4/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
MAOA P21397 3/20 0.56
NFE2L2 Q16236 1/20 0.56
CYP19A1 P11511 1/20 0.56
CHRM5 P08912 1/20 0.56
FBP1 P09467 1/20 0.55
EGFR P00533 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
AKR1C3 P42330 1/20 0.50
GRIN1 Q05586 1/20 0.50
GRIN2B Q13224 1/20 0.50

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
SCHEMBL29446280 1.00 CHAT (0.66) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL699874 1.00 CHAT (0.66) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL699364 0.93 CHAT (0.67) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL699365 0.93 CHAT (0.67) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL13291663 0.91 MAOB (0.61) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL28626001 0.88 RELA (0.67) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL700046 0.88 RELA (0.67) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL700045 0.88 RELA (0.67) CHATRELAMAOBCYP1A2CYP2C9
SCHEMBL30081496 0.88 RELA (0.67) CHATRELAMAOBCYP1A2CYP2C9
(Z)-1,2-Diphenylethene SCHEMBL28535457 0.85 TSHR (0.65) CHATMAOBMAOANFE2L2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021074275-A1 EFFECTIVE PHOTOMODULATION OF LANTHANIDE (III) ION LUMINESCENCE IN THE VISIBLE OR NEAR-INFRARED RANGE UNIVERSITE DE RENNES 1 (FR) 2021-04-22 WO disclosed
CN-110256192-A It is a kind of using alcohol be hydrogen source Photocatalysis selectivity synthesis cis and trans olefins process 南通大学 2019-09-20 CN disclosed
CN-110218141-A A kind of Photocatalysis selectivity synthesis Z- and E- olefins process 南通大学 2019-09-10 CN disclosed
CN-109134172-A The alcohol hydrogen supply iridium catalytic selectivity of ligand regulation synthesizes Z- and E- olefins process 南通大学 2019-01-04 CN disclosed
US-9925153-B2 Therapeutic agents for skin diseases and conditions STC.UNM (US) 2018-03-27 US disclosed
US-9868873-B2 Photochromic security enabled ink for digital offset printing applications XEROX CORPORATION (US) 2018-01-16 US disclosed
US-9718763-B2 Catalytic ester decarbonylation REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2017-08-01 US disclosed
US-20160287531-A1 THERAPEUTIC AGENTS FOR SKIN DISEASES AND CONDITIONS STC.UNM 2016-10-06 US disclosed
US-20160194276-A1 CATALYTIC ESTER DECARBONYLATION REGENTS OF THE UNIVERSITY OF MINNESOTA 2016-07-07 US disclosed
US-8980954-B2 Substituted cis- and trans-stilbenes as therapeutic agents STC.UNM (US) 2015-03-17 US disclosed
US-20050244744-A1 Method for forming temporary image XEROX CORPORATION 2005-11-03 US disclosed
US-20050244743-A1 Reimageable medium XEROX CORPORATION. 2005-11-03 US disclosed
EP-1591830-A2 Reimageable medium Xerox Corporation (US) 2005-11-02 EP disclosed
EP-1591831-A2 Reimageable medium with light absorbing material Xerox Corporation (US) 2005-11-02 EP disclosed
EP-1591829-A1 Method for forming temporary image Xerox Corporation (US) 2005-11-02 EP disclosed
US-5759729-A A DRY TONER COMPRISING A RESIN, PHOTOCHROMATIC SPIROPYRAN, -OXAZINE OR -THIOPYRAN DYE AND A CHARGE CONTROL AGENT;ELECTROGRAPHY; XEROGRAPHY XEROX CORPORATION (US) 1998-06-02 US disclosed
US-5710420-A Method for embedding and recovering machine-readable information XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5633109-A Ink compositions with liposomes containing photochromic compounds XEROX CORPORATION (US) 1997-05-27 US disclosed
US-5593486-A Photochromic hot melt ink compositions XEROX CORPORATION (US) 1997-01-14 US disclosed
US-5551973-A LIQUID CRYSTAL GEL PHASE, MICROEMULSION PHASE XEROX CORPORATION (US) 1996-09-03 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-20160287531-A1 THERAPEUTIC AGENTS FOR SKIN DISEASES AND CONDITIONS CUTA, TSLP, ELANE CHAT 2682/4885RELA 29/4885MAOB 961/4885
US-20160194276-A1 CATALYTIC ESTER DECARBONYLATION DECR1, C1S, CBR3 CHAT 599/4885RELA 1378/4885MAOB 243/4885

“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.