SCHEMBL6534274

SCHEMBL6534274

Clc1ccc(-c2cc(Cl)c3ccccc3n2)cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
MAPT P10636 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
DHODH Q02127 3/20 0.49
ESR1 P03372 2/20 0.49
ESR2 Q92731 2/20 0.49
ESRRB O95718 1/20 0.49
ESRRA P11474 1/20 0.49
KMO O15229 2/20 0.46
ACHE P22303 1/20 0.46
IDO1 P14902 1/20 0.45
ACP1 P24666 1/20 0.45
AHR P35869 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
SCHEMBL30592743 0.86 DHODH (0.58) MEN1MAPTKMT2APOLBHTT
SCHEMBL29793367 0.85 ACHE (0.61) MEN1CYP2C9KMT2ADHODHESR1
SCHEMBL785473 0.85 ACHE (0.61) MEN1CYP2C9KMT2ADHODHESR1
SCHEMBL6534253 0.85 TP53 (0.47) MEN1MAPTKMT2ADHODHESR1
SCHEMBL16098476 0.85 MEN1 (0.53) MEN1CYP1A2CYP2D6MAPTCYP2C9
SCHEMBL31134275 0.85 CYP1A1 (0.50) MEN1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL6534364 0.85 CYP1A1 (0.50) MEN1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL6534331 0.84 NPC1 (0.54) MEN1CYP1A2CYP2D6MAPTCYP2C19
SCHEMBL6534406 0.82 NPC1 (0.56) MEN1MAPTKMT2ANPSR1POLB
SCHEMBL18868897 0.82 MAOA (0.56) MEN1CYP1A2CYP2D6MAPTCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10179770-B2 Quinolines derivatives as novel anticancer agents GENOSCIENCE PHARMA (FR) 2019-01-15 US disclosed
US-10179770-B2 Quinolines derivatives as novel anticancer agents GENOSCIENCE PHARMA (FR) 2019-01-15 US disclosed
CN-105102442-B Quinoline as anticarcinogen 基因科学医药公司 2018-11-09 CN disclosed
EP-2976333-B1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA SAS (FR) 2018-08-08 EP disclosed
EP-2976333-B1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA SAS (FR) 2018-08-08 EP disclosed
US-20160280653-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA (FR) 2016-09-29 US disclosed
US-20160280653-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA (FR) 2016-09-29 US disclosed
US-20160280653-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA (FR) 2016-09-29 US disclosed
EP-2976333-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS Genoscience Pharma SAS (FR) 2016-01-27 EP disclosed
CN-105102442-A Quinolines derivatives as novel anticancer agents GENOSCIENCE PHARMA 2015-11-25 CN disclosed
WO-2014147611-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA (FR) 2014-09-25 WO disclosed
WO-2014147611-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS GENOSCIENCE PHARMA (FR) 2014-09-25 WO disclosed
EP-1088818-B1 Quinolin-4-yl derivatives HOFFMANN LA ROCHE (CH) 2004-11-03 EP disclosed
US-6440995-B1 NMDA-RECEPTOR SUBTYPE SELECTIVE BLOCKERS HOFFMAN-LA ROCHE INC. 2002-08-27 US disclosed
EP-1088818-A1 Quinolin-4-yl derivatives F. HOFFMANN-LA ROCHE AG (CH) 2001-04-04 EP 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-10179770-B2 Quinolines derivatives as novel anticancer agents NQO2, MKI67, NQO1 MEN1 895/4885CYP1A2 1304/4885CYP2D6 1428/4885
US-20160280653-A1 QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS NQO2, MKI67, NQO1 MEN1 895/4885CYP1A2 1304/4885CYP2D6 1428/4885

“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.