SCHEMBL10707751

SCHEMBL10707751

COC(Cl)(Cl)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.44
CES1 P23141 1/20 0.42
KCNN4 O15554 5/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 1/20 0.41
ALOX15 P16050 1/20 0.41
CA4 P22748 1/20 0.38
TAAR1 Q96RJ0 1/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL10499996 0.79 TSHR (0.50) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL4073627 0.79 TSHR (0.50) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL547587 0.78 TSHR (0.55) TSHRMAPK1KCNN4ALDH1A1CYP1A2
SCHEMBL995346 0.78 TSHR (0.55) TSHRMAPK1KCNN4ALDH1A1CYP1A2
SCHEMBL11034971 0.76 MAPK1 (0.46) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL11420583 0.75 TSHR (0.46) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL27387986 0.75 TSHR (0.46) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL14697338 0.75 TSHR (0.46) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL28337911 0.75 TSHR (0.46) TSHRMAPK1CES1KCNN4ALDH1A1
SCHEMBL28090932 0.74 ALDH1A1 (0.52) TSHRMAPK1CES1KCNN4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114105984-B Method for preparing indolizine type corrosion inhibitor 中国石油大学(华东) 2023-08-25 CN claimed
CN-120118067-A Estrogen receptor modulators and uses thereof 江苏威凯尔医药科技股份有限公司 2025-06-10 CN disclosed
EP-2770827-B1 COMPOSITION, METHOD FOR PRODUCING THE COMPOSITION, AND PHYTOSANITARY FORMULATION CONTAINING SAME RHODIA OPERATIONS (FR) 2019-07-17 EP disclosed
EP-2547199-B1 NOVEL USES OF ESTERAMIDE COMPOUNDS RHODIA OPERATIONS (FR) 2018-05-16 EP disclosed
EP-2547651-B1 ESTERAMIDE COMPOUNDS, METHODS FOR PREPARING SAME, AND USES THEREOF RHODIA OPERATIONS (FR) 2016-10-19 EP disclosed
EP-2961739-A2 FURFURAL DERIVATIVES AS A VEHICLE Rhodia Operations (FR) 2016-01-06 EP disclosed
WO-2014132178-A2 FURFURAL DERIVATIVES AS A VEHICLE RHODIA OPERATIONS (FR) 2014-09-04 WO disclosed
EP-2770827-A1 COMPOSITION, METHOD FOR PRODUCING THE COMPOSITION, AND PHYTOSANITARY FORMULATION CONTAINING SAME Rhodia Operations (FR) 2014-09-03 EP disclosed
WO-2013053834-A1 COMPOSITION, METHOD FOR PRODUCING THE COMPOSITION, AND PHYTOSANITARY FORMULATION CONTAINING SAME RHODIA OPERATIONS (FR) 2013-04-18 WO disclosed
EP-2547651-A1 NOVEL ESTERAMIDE COMPOUNDS, METHODS FOR PREPARING SAME, AND USES THEREOF Rhodia Operations (FR) 2013-01-23 EP disclosed
EP-2547199-A2 NOVEL USES OF ESTERAMIDE COMPOUNDS Rhodia Operations (FR) 2013-01-23 EP disclosed
EP-0201417-B1 SURFACTANT COMPOSITION, PROCESS FOR ITS PREPARATION AND ITS USE RHONE-POULENC CHIMIE (FR) 1988-09-14 EP disclosed
EP-0201417-A1 Surfactant composition, process for its preparation and its use RHONE-POULENC CHIMIE (FR) 1986-11-12 EP disclosed
EP-0009787-B2 PROCESS FOR THE MONOHALOGENATION OF ALKYLBENZENES IN ALPHA POSITION BAYER AG (DE) 1986-07-09 EP disclosed
US-4331821-A ULTRAVIOLET RADIATION OF A VAPORIZED ALKYLBENZEN AND HALOGEN GAS MIXTURE BAYER AKTIENGESELLSCHAFT (DE) 1982-05-25 US disclosed
EP-0009787-B1 PROCESS FOR THE MONOHALOGENATION OF ALKYLBENZENES IN ALPHA POSITION BAYER AG (DE) 1982-01-13 EP disclosed