SCHEMBL203068

SCHEMBL203068

Clc1ccc2ccc(CBr)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.48
NR4A2 P43354 1/20 0.46
PDE10A Q9Y233 1/20 0.42
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
HRH3 Q9Y5N1 1/20 0.37
F7 P08709 1/20 0.36
F3 P13726 1/20 0.36
DYRK1A Q13627 1/20 0.36
PIK3CG P48736 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
CYP2A6 P11509 1/20 0.35
CMA1 P23946 1/20 0.35
AHR P35869 1/20 0.35
CYP1A2 P05177 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL29518426 1.00 CCR1 (0.48) CCR1NR4A2PDE10AHTR3EHTR3B
SCHEMBL201434 0.86 CCR1 (0.47) CCR1NR4A2PDE10AHTR3AHRH3
SCHEMBL7086026 0.86 NR4A2 (0.39) CCR1NR4A2PDE10ACYP2A6
SCHEMBL27350783 0.85 PDE10A (0.46) NR4A2PDE10AHTR3EHTR3BHTR3A
SCHEMBL3276372 0.82 NR4A2 (0.47) NR4A2PDE10AHTR3EHTR3BHTR3A
SCHEMBL9203570 0.80 CCR1 (0.48) CCR1PDE10AHRH3DYRK1ALMNA
SCHEMBL4348088 0.80 LOXL2 (0.47) NR4A2PDE10AHTR3EHTR3BHTR3A
SCHEMBL13878246 0.80 NR4A2 (0.46) NR4A2PDE10AHTR3EHTR3BHTR3A
SCHEMBL1911781 0.80 NR4A2 (0.46) NR4A2PDE10AHTR3EHTR3BHTR3A
SCHEMBL28887330 0.80 S1PR4 (0.49) NR4A2PDE10AHTR3EHTR3BHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105732583-B A kind of target compound for treating Gliblastoma 苏州麦迪耐斯医药科技有限公司 2018-05-04 CN claimed
CN-105732583-A Targeted compound for treating glioblastoma multiforme 苏州麦迪耐斯医药科技有限公司 2016-07-06 CN claimed
US-20250179008-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. (US) 2025-06-05 US disclosed
CN-105732583-B A kind of target compound for treating Gliblastoma 苏州麦迪耐斯医药科技有限公司 2018-05-04 CN disclosed
US-9682971-B2 1,2,5-Substituted benzimidazoles as flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-06-20 US disclosed
US-9682972-B2 1,2,5-substituted benzimidazoles as flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-06-20 US disclosed
CN-105732583-A Targeted compound for treating glioblastoma multiforme 苏州麦迪耐斯医药科技有限公司 2016-07-06 CN disclosed
US-20160108028-A1 1,2,5-SUBSTITUTED BENZIMIDAZOLES AS FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2016-04-21 US disclosed
US-9290485-B2 N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides NOVARTIS AG (CH) 2016-03-22 US disclosed
US-9290485-B2 N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides NOVARTIS AG (CH) 2016-03-22 US disclosed
US-9290485-B2 N-((6-amino-pyridin-3-yl)methyl)-heteroaryl-carboxamides NOVARTIS AG (CH) 2016-03-22 US disclosed
US-5021576-A Antiinflammatory, antiarthritic, hypotensive, anticarcinogenic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1991-06-04 US disclosed
WO-1991006539-A1 2-ANILINO PHENYLACETIC ACID DERIVATIVES AS INHIBITORS OF PLA2 AND LIPOXYGENASE AMERICAN HOME PRODUCTS CORPORATION (US) 1991-05-16 WO disclosed
EP-0419049-A1 (Quinolin-2-ylmethoxy) indoles as inhibitors of the biosynthesis of leukotrienes MERCK FROSST CANADA INC. (CA) 1991-03-27 EP disclosed
EP-0399818-A1 Diarylstyrylquinoline diacids MERCK FROSST CANADA INC. (CA) 1990-11-28 EP disclosed
EP-0349062-A1 Quinoline ether alkanoic acid MERCK FROSST CANADA INC. (CA) 1990-01-03 EP disclosed
US-4851409-A LEUKOTRIENE ANTAGONIST, ANTIASTHMA, ANTIALLERGEN, ANTIINFLAMMATORY, CYTOPROTECTIVE MERCK FROSST CANADA INC. (CA) 1989-07-25 US disclosed
EP-0318093-A2 Diarylquinoline diacids and their use as medicaments MERCK FROSST CANADA INC. (CA) 1989-05-31 EP disclosed
EP-0271287-A2 Quinoline dioic acids and amides MERCK FROSST CANADA INC. (CA) 1988-06-15 EP disclosed
EP-0233763-A2 2-Substituted quinoline dioic acids MERCK FROSST CANADA INC. (CA) 1987-08-26 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-20250179008-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 CCR1 286/4885NR4A2 1340/4885PDE10A 4370/4885
US-20160108028-A1 1,2,5-SUBSTITUTED BENZIMIDAZOLES AS FLAP MODULATORS FEN1, FOXM1, CYP3A5 CCR1 311/4885NR4A2 2714/4885PDE10A 211/4885

“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.