SCHEMBL102201

SCHEMBL102201

Clc1ncnc2[nH]ccc12

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TTBK1 Q5TCY1 7/20 0.54
TTBK2 Q6IQ55 7/20 0.54
AXL P30530 2/20 0.53
PRKCI P41743 2/20 0.53
JAK2 O60674 1/20 0.52
JAK3 P52333 3/20 0.49
DYRK1A Q13627 1/20 0.48
TRPA1 O75762 1/20 0.47
EGFR P00533 1/20 0.46
HPGDS O60760 1/20 0.46
HTR2C P28335 1/20 0.46
AKT2 P31751 1/20 0.45
GSK3B P49841 1/20 0.45

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
Bicarbonate SCHEMBL28415325 0.89 NOTUM (0.51) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL16979002 0.79 TTBK1 (0.40) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL16979012 0.79 PRKCI (0.50) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL19292230 0.76 DYRK1A (0.51) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL29407654 0.76 JAK2 (0.53) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL39050 0.76 JAK2 (0.53) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL24345975 0.75 AKT2 (0.50) TTBK1TTBK2JAK2JAK3TRPA1
SCHEMBL12997948 0.74 JAK2 (0.52) TTBK1TTBK2AXLPRKCIJAK2
Hydrochloric Acid SCHEMBL7018150 0.74 JAK2 (0.52) TTBK1TTBK2AXLPRKCIJAK2
SCHEMBL95556 0.74 TTBK1 (0.54) TTBK1TTBK2JAK2JAK3TRPA1

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

Appears in 3429 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115684424-B Method for detecting 4-chloro-7H-pyrrolo [2,3-d ] pyrimidine in soil and water based on LC-MS/MS 贵州健安德科技有限公司 2024-12-27 CN claimed
CN-118146226-A Pyrrolo [2,3-d ] pyrimidine compound with nitrogen-containing heterocyclic structure, and preparation method and application thereof 贵州大学 2024-06-07 CN claimed
CN-117756810-A Preparation method of trans-7H-pyrrolo [2,3-d ] pyrimidine compound 苏州莱安医药化学技术有限公司 2024-03-26 CN claimed
CN-115232130-B APN and AKT double-target inhibitor and preparation method and application thereof 山东大学 2024-01-12 CN claimed
CN-113354650-B Preparation method of 4-chloro-7H-pyrrolo [2,3-d ] pyrimidine-5-carbonitrile 安徽大学 2023-12-19 CN claimed
WO-2023125373-A1 METHOD FOR PREPARING RUXOLITINIB AND INTERMEDIATE THEREOF 江苏威凯尔医药科技有限公司 2023-07-06 WO claimed
EP-3472169-B1 METHOD OF MANUFACTURING 4-CHLORO-7H-PYRROLO[2,3-d]PYRIMIDINE SIEGFRIED NANTONG PHARMACEUTICALS CO LTD (CN) 2023-04-19 EP claimed
CN-115684424-A LC-MS/MS-based method for detecting 4-chloro-7H-pyrrolo [2,3-d ] pyrimidine in soil and water 贵州健安德科技有限公司 2023-02-03 CN claimed
CN-115340557-A Synthesis method of 4-chloro-5-iodo-7-methyl-7H-pyrrolo [2,3-d ] pyrimidine 安徽大学 2022-11-15 CN claimed
CN-113549077-B Production process of 4-chloropyrrolo [2,3-d ] pyrimidine 浙江倍合德制药有限公司 2022-11-11 CN claimed
WO-2016125080-A2 PROCESS FOR THE PREPARATION OF BARICITINIB AND AN INTERMEDIATE THEREOF SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2016-08-11 WO claimed
WO-2016088094-A1 PROCESS FOR THE PREPARATION OF BARICITINIB AND AN INTERMEDIATE THEREOF SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2016-06-09 WO claimed
US-20160122354-A1 PROCESS FOR THE PREPARATION OF (3R,4R)-4-METHYL-3-(METHYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL-AMINO)-ß-OXO-1-PIPERIDINEPROPANENITRILE AND ITS SALTS THIRUMALAI RAJAN SRINIVASAN (IN) 2016-05-05 US claimed
CN-105218554-A The synthesis technique of 4-chlorine pyrrolo-[2,3-D] pyrimidine SHANGHAI TITAN TECHNOLOGY CO LTD 2016-01-06 CN claimed
WO-2005016878-A2 METHODS FOR THE PREPARATION OF 5-FLUORO-PYRROLO[2,3-d]PYRIMIDINE COMPOUNDS ISIS PHARMACEUTICALS, INC. (US) 2005-02-24 WO claimed
EP-0085440-B1 PRODUCTION OF 4-CHLORO-7-(2,3,5-TRI-O-BENZYL-BETA-D-ARABINOFURANOSYL)-7H-PYRROLO(2,3-D) PYRIMIDINE COMPOUNDS WARNER-LAMBERT COMPANY (US) 1985-10-09 EP claimed
EP-0057548-B1 7-BETA-D-ARABINOFURANOSYL-7H-PYRROLO(2,3-D)PYRIMIDINE-4-AMINE 5'-PHOSPHATE COMPOUNDS USEFUL AS ANTIVIRAL AGENTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THE COMPOUNDS, AND PROCESSES FOR PRODUCING THE COMPOUNDS WARNER-LAMBERT COMPANY (US) 1985-07-03 EP claimed
US-4439604-A 7-β-D-Arabinofuranosyl-7H-pyrrolo[2,3-d]pyrimidine compounds and methods for their production WARNER-LAMBERT COMPANY (US) 1984-03-27 US claimed
EP-0085440-A1 Production of 4-chloro-7-(2,3,5-tri-O-benzyl-beta-D-arabinofuranosyl)-7H-pyrrolo(2,3-d) pyrimidine compounds WARNER-LAMBERT COMPANY (US) 1983-08-10 EP claimed
EP-0057548-A2 7-Beta-D-arabinofuranosyl-7H-pyrrolo(2,3-d)pyrimidine-4-amine 5'-phosphate compounds useful as antiviral agents, pharmaceutical compositions containing the compounds, and processes for producing the compounds WARNER-LAMBERT COMPANY (US) 1982-08-11 EP claimed