SCHEMBL2045883

SCHEMBL2045883

Clc1ccccc1C[Mg]Br

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.52
PNMT P11086 1/20 0.52
TAAR1 Q96RJ0 4/20 0.48
PKM P14618 1/20 0.43
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CHRM2 P08172 1/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
AOC3 Q16853 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KCNH2 Q12809 1/20 0.41
DPP4 P27487 1/20 0.40

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
SCHEMBL187563 0.80 IDO1 (0.52) IDO1PNMTTAAR1PKMLMNA
SCHEMBL23881742 0.79 TAAR1 (0.54) IDO1PNMTTAAR1PKMNPC1
SCHEMBL1437844 0.78 PNMT (0.39) IDO1PNMTTAAR1CYP1A2CYP3A4
SCHEMBL6295032 0.75 TAAR1 (0.44) PNMTTAAR1LMNATSHRNPC1
SCHEMBL1821 0.74
SCHEMBL29413238 0.74
SCHEMBL29519238 0.73 IDO1 (0.62) IDO1PNMTTAAR1PKMLMNA
SCHEMBL672407 0.73 IDO1 (0.62) IDO1PNMTTAAR1PKMLMNA
SCHEMBL6740216 0.73 TAAR1 (0.71) IDO1PNMTTAAR1PKMLMNA
SCHEMBL376871 0.72 TAAR1 (0.50) IDO1TAAR1LMNATSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12559466-B2 Process for preparation of intermediates UPL LTD (IN) 2026-02-24 US disclosed
EP-4385329-A2 IMPROVED PROCESS FOR PREPARATION OF INTERMEDIATES UPL Ltd (IN) 2024-06-19 EP disclosed
CN-112399967-A Improved process for the preparation of intermediates UPL有限公司 2021-02-23 CN disclosed
US-20200399236-A1 IMPROVED PROCESS FOR PREPARATION OF INTERMEDIATES UPL LTD (IN) 2020-12-24 US disclosed
CN-101970391-B Process for preparing pharmaceutical intermediates EGIS GYOGYSZERGYAR NYILVANOSAN 2013-09-18 CN disclosed
US-8394993-B2 Process for the preparation of pharmaceutical intermediates EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2013-03-12 US disclosed
EP-2231575-B1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATES EGIS GYOGYSZERGYAR NYILVANOSAN MUEKOEDOE RESZVENYTARSASAG (HU) 2011-06-22 EP disclosed
US-20100274020-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATES EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2010-10-28 US disclosed
CN-1878762-B Morpholine derivatives as norepinephrine reuptake inhibitors LILLY CO ELI 2010-10-27 CN disclosed
EP-2231575-A2 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATES Egis Gyógyszergyár Nyilvánosan Müködö Részvénytársaság (HU) 2010-09-29 EP disclosed
EP-1682523-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-07-26 EP disclosed
US-6951942-B2 Glucocorticoid-selective anti-inflammatory agents ABBOTT LABORATORIES (US) 2005-10-04 US disclosed
WO-2005047272-A1 MORPHOLINE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-05-26 WO disclosed
US-20030073703-A1 Glucocortiocoid-selective antinflammatory agents ABBOTT LABORATORIES AND LIGAND PHARMACEUTICALS INCORPORATED 2003-04-17 US disclosed
EP-1299392-A2 GLUCOCORTIOCOID-SELECTIVE ANTIINFLAMMATORY AGENTS Abbott Laboratories (US) 2003-04-09 EP disclosed
US-6506766-B1 A pharmaceutical composition for use in treating inflammation, immune, autoimmune, and inflammatory diseases in a mammal by selectively modulating the activation, repression, agonism, and antagonism effects of the mammal's glucocorticoid ABBOTT LABORATORIES 2003-01-14 US disclosed
EP-1053239-B1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LAB (US) 2003-01-08 EP disclosed
WO-2002002565-A2 GLUCOCORTIOCOID-SELECTIVE ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 2002-01-10 WO disclosed
EP-1053239-A1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 2000-11-22 EP disclosed
WO-1999041256-A1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1999-08-19 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 (4 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-12559466-B2 Process for preparation of intermediates CBR1, POR, CYP2E1 IDO1 321/4885PNMT 445/4885TAAR1 500/4885
US-20100274020-A1 PROCESS FOR THE PREPARATION OF PHARMACEUTICAL INTERMEDIATES PF4, F2, F3 IDO1 3637/4885PNMT 3968/4885TAAR1 3966/4885
US-20200399236-A1 IMPROVED PROCESS FOR PREPARATION OF INTERMEDIATES OGDH, OXGR1, POR IDO1 528/4885PNMT 465/4885TAAR1 721/4885
US-20030073703-A1 Glucocortiocoid-selective antinflammatory agents NR3C1, GPR119, MC2R IDO1 564/4885PNMT 4055/4885TAAR1 678/4885

“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.