SCHEMBL6960490

SCHEMBL6960490

Clc1ccc(-c2cnccn2)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 4/20 0.65
SLC6A2 P23975 1/20 0.51
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51
KMO O15229 6/20 0.50
AHR P35869 2/20 0.48
ADORA2A P29274 1/20 0.47
PIK3CD O00329 1/20 0.46
PIK3CA P42336 1/20 0.46
PIK3CB P42338 1/20 0.46
PI4KA P42356 1/20 0.46
PIK3CG P48736 1/20 0.46
PI4KB Q9UBF8 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
PKM P14618 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP19A1 P11511 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL12492145 0.84 CYP3A4 (0.52) NPY5RSLC6A2SLC6A4SLC6A3KMO
SCHEMBL25326508 0.84 KMO (0.49) NPY5RSLC6A2SLC6A4SLC6A3KMO
SCHEMBL28629827 0.83 NPY5R (0.63) NPY5RSLC6A2SLC6A4SLC6A3KMO
SCHEMBL29712850 0.83 NPY5R (0.63) NPY5RSLC6A2SLC6A4SLC6A3KMO
SCHEMBL28638540 0.80 NPY5R (1.00) NPY5RADORA2A
SCHEMBL11541937 0.79 CYP2D6 (0.60) NPY5RPIK3CDPIK3CAPIK3CBPI4KA
SCHEMBL16995118 0.79 PIM2 (0.52) NPY5RKMOPIM1PIM2ALDH1A1
SCHEMBL28185286 0.79 MKNK1 (0.47) NPY5RKMOPIK3CDPIK3CAPIK3CB
SCHEMBL10353034 0.78 RAB9A (0.60) NPY5RSLC6A2SLC6A4SLC6A3PIK3CD
SCHEMBL30112767 0.76 HSD11B1 (0.48) NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117820318-A P-type organic positive electrode material and preparation method and application thereof 上海电力大学 2024-04-05 CN disclosed
CN-117402494-A Complex high-strength polyarylene sulfide based composite material and preparation and application thereof 新凝合科技(成都)有限公司 2024-01-16 CN disclosed
CN-115895441-B Electrostatic spraying coating for glove mold and preparation method thereof 南通源创设备科技有限公司 2023-12-22 CN disclosed
CN-111057004-B N-o-substituted phenyl benzamide-4-methylaminoacridine compound and preparation method and application thereof 宁波大学 2023-10-31 CN disclosed
CN-116924995-A Method for synthesizing benzimidazole compound by catalyzing L-phenylalanine 宁夏师范学院 2023-10-24 CN disclosed
CN-114989094-B Method for synthesizing benzimidazole derivative by visible light catalysis 云南民族大学 2023-09-29 CN disclosed
CN-114890952-B Preparation method of 5-halogeno-2-aminobenzoazacyclic compound 重庆医科大学 2023-06-06 CN disclosed
US-20170299530-A1 COMPOUNDS AND METHODS FOR ANALYSIS AND SYNTHESIS OF SACCHARIDE COMPOUNDS, AND METHOD FOR QUANTITATING SACCHARIDE ACADEMIA SINICA (TW) 2017-10-19 US disclosed
US-20150168415-A1 COMPOUNDS AND METHODS FOR ANALYSIS AND SYNTHESIS OF SACCHARIDE COMPOUNDS ACADEMIA SINICA (TW) 2015-06-18 US disclosed
EP-0927170-B1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORP (US) 2003-10-08 EP disclosed
US-5981520-A USEFUL FOR TREATING ASTHMA, BRONCHOSPASM, ALLERGIES, ANXIETY, COUGHING OR PAIN SCHERING CORPORATION (US) 1999-11-09 US disclosed
EP-0927170-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1999-07-07 EP disclosed
US-5892039-A Piperazino derivatives as neurokinin antagonists SCHERING CORPORATION (US) 1999-04-06 US disclosed
US-5795894-A TREATMENT OF ASTHMA AND BRONCHOSPASM SCHERING CORPORATION (US) 1998-08-18 US disclosed
WO-1998008826-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1998-03-05 WO disclosed
EP-0823906-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1998-02-18 EP disclosed
WO-1996034864-A1 PIPERAZINO DERIVATIVES AS NEUROKININ ANTAGONISTS SCHERING CORPORATION (US) 1996-11-07 WO disclosed
EP-0204172-B1 PHENYLPYRAZINE DERIVATIVES, PROCESSES FOR PREPARING THEM, PHARMACEUTICAL COMPOSITION AND USE SUNTORY LIMITED (JP) 1990-09-19 EP disclosed
US-4755514-A Phenylpyrazine derivatives and thrombolytic agent SUNTORY LIMITED (JP) 1988-07-05 US disclosed
EP-0204172-A2 Phenylpyrazine derivatives, processes for preparing them, pharmaceutical composition and use SUNTORY LIMITED (JP) 1986-12-10 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 (1 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-20150168415-A1 COMPOUNDS AND METHODS FOR ANALYSIS AND SYNTHESIS OF SACCHARIDE COMPOUNDS MPI, GPI, FUT6 NPY5R 1977/4885SLC6A2 2652/4885SLC6A4 1468/4885

“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.