SCHEMBL1273995

SCHEMBL1273995

Clc1cccc(C2CC2)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.48
HTR2C P28335 1/20 0.48
HTR2B P41595 1/20 0.48
TSHR P16473 3/20 0.46
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
KMT2A Q03164 1/20 0.43
SLC6A3 Q01959 2/20 0.42
HTR1A P08908 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
IDO1 P14902 2/20 0.42
GRIA1 P42261 1/20 0.41
CACNG8 Q8WXS5 1/20 0.41
GRM2 Q14416 2/20 0.40
TP53 P04637 1/20 0.39
RECQL P46063 1/20 0.39
P2RX7 Q99572 1/20 0.39
OPRL1 P41146 1/20 0.39
PNMT P11086 1/20 0.38

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
SCHEMBL126651 0.89 CEL (0.46) HTR2AHTR2CHTR2BTSHRMEN1
SCHEMBL24069104 0.89 CEL (0.46) HTR2AHTR2CHTR2BTSHRMEN1
SCHEMBL3794742 0.87 OPRL1 (0.41) HTR2AHTR2CHTR2BTSHRSLC6A3
SCHEMBL245508 0.86 SLC6A2 (0.57) HTR2CSLC6A3HTR1ASLC6A2SLC6A4
SCHEMBL5584834 0.86 HTR2A (0.42) HTR2AHTR2CHTR2BTSHRMEN1
SCHEMBL3397657 0.84 IDO1 (0.45) HTR2AHTR2CHTR2BTSHRMEN1
SCHEMBL3773284 0.82 DRD2 (0.50) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL2047547 0.82 TAS1R3 (0.44) HTR2AHTR2CHTR2BTSHRIDO1
SCHEMBL1897406 0.80 TP53 (0.57) HTR2AHTR2CHTR2BTSHRGRM2
SCHEMBL3785910 0.79 SMN1; SMN2 (0.41) HTR2AHTR2CHTR2BGRIA1CACNG8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2882722-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS Envoy Therapeutics Inc. (US) 2015-06-17 EP disclosed
WO-2014028479-A1 QUINOXALINE DERIVATIVES AS GPR6 MODULATORS ENVOY THERAPEUTICS, INC. (US) 2014-02-20 WO disclosed
US-20120172392-A1 AMINE-BASED AND AMIDE-BASED INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE (SSAO) ENZYME ACTIVITY AND VAP-1 MEDIATED ADHESION USEFUL FOR TREATMENT OF DISEASES SALTER-CID LUISA M (US) 2012-07-05 US disclosed
CN-1934142-B High-activity magnesium supported catalyst and method for preparing polyolefin by using same LG CHEMICAL LTD 2011-05-25 CN disclosed
EP-2283833-A2 Amines and amides for the treatment of diseases LA JOLLA PHARMACEUTICAL CO. (US) 2011-02-16 EP disclosed
EP-1807454-A1 HIGH-ACTIVITY MAGNESIUM-SUPPORTED CATALYST AND METHOD OF PREPARING POLYOLEFIN USING THE SAME LG Chem, Ltd. (KR) 2007-07-18 EP disclosed
US-20070078157-A1 Amine-based and amide-based inhibitors of semicarbazide-sensitive amine oxidase (SSAO)enzyme activity and VAP-1 mediated adhesion useful for treatment of diseases LA JOLLA PHARMACEUTICAL COMPANY (US) 2007-04-05 US disclosed
CN-1934142-A High-activity magnesium supported catalyst and method for preparing polyolefin by using same LG CHEMICAL LTD (KR) 2007-03-21 CN disclosed
EP-1732531-A2 AMINES AND AMIDES FOR THE TREATMENT OF DISEASES LA JOLLA PHARMACEUTICAL COMPANY (US) 2006-12-20 EP disclosed
US-20060111524-A1 High-activity magnesium-supported catalyst and method of preparing polyolefin using the same LG CHEM, LTD. (KR) 2006-05-25 US disclosed
WO-2006049431-A1 HIGH-ACTIVITY MAGNESIUM-SUPPORTED CATALYST AND METHOD OF PREPARING POLYOLEFIN USING THE SAME LG CHEM, LTD. (KR) 2006-05-11 WO disclosed
US-20060025438-A1 Amine-based and amide-based inhibitors of semicarbazide-sensitive amine oxidase (SSAO) enzyne activity and VAP-1 mediated adhesion useful for treatment of diseases LA JOLLA PHARMACEUTICAL COMPANY 2006-02-02 US disclosed
WO-2005082343-A2 AMINES AND AMIDES FOR THE TREATMENT OF DISEASES LA JOLLA PHARMACEUTICAL COMPANY (US) 2005-09-09 WO 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 (3 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-20070078157-A1 Amine-based and amide-based inhibitors of semicarbazide-sensitive amine oxidase (SSAO)enzyme activity and VAP-1 mediated adhesion useful for treatment of diseases VCAM1, AOC2, AOC1 HTR2A 3494/4885HTR2C 4045/4885HTR2B 2767/4885
US-20120172392-A1 AMINE-BASED AND AMIDE-BASED INHIBITORS OF SEMICARBAZIDE-SENSITIVE AMINE OXIDASE (SSAO) ENZYME ACTIVITY AND VAP-1 MEDIATED ADHESION USEFUL FOR TREATMENT OF DISEASES VCAM1, AOC2, AOC1 HTR2A 3494/4885HTR2C 4045/4885HTR2B 2767/4885
US-20060025438-A1 Amine-based and amide-based inhibitors of semicarbazide-sensitive amine oxidase (SSAO) enzyne activity and VAP-1 mediated adhesion useful for treatment of diseases VCAM1, AOC3, AOC2 HTR2A 1447/4885HTR2C 2952/4885HTR2B 1816/4885

“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.