SCHEMBL352433

SCHEMBL352433

Clc1nc(Cl)c2ccnc-2[nH]1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
RHEB Q15382 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
JAK2 O60674 1/20 0.30

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
SCHEMBL1335301 0.82 NUDT1 (0.37) NPC1RAB9AMEN1KMT2ARHEB
SCHEMBL3011647 0.80 ALDH1A1 (0.34) NPC1RAB9AMEN1KMT2ARHEB
SCHEMBL2231635 0.77 MTOR (0.44) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL3877175 0.77 HPGD (0.40) NPC1RAB9AMEN1KMT2ARHEB
SCHEMBL5120449 0.76 KDM4E (0.38) RHEBKDM4EALDH1A1JAK2
SCHEMBL2869368 0.76 DYRK1A (0.34) NPC1RAB9AMEN1KMT2A
SCHEMBL4367099 0.71 ALDH1A1 (0.46) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL102202 0.68 MEN1 (0.33) NPC1RAB9AMEN1KMT2A
SCHEMBL1335315 0.68 SMN1; SMN2 (0.42) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL1021282 0.67 MAPT (0.39) NPC1RAB9AKMT2AKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107793417-A Pyrrolo- [2,3 d] pyrimidines and its salt, and preparation method and pharmaceutical usage 复旦大学 2018-03-13 CN claimed
WO-2024131942-A1 CYCLOPROPANE TLR7 AND TLR8 INHIBITOR, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海深势唯思科技有限责任公司 2024-06-27 WO disclosed
CN-118239959-A Cyclopropane TLR7 and 8 inhibitor and preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. 2024-05-30 US disclosed
WO-2024073073-A2 KINASE MODULATORS AND METHODS OF USE THEREOF NEURON23, INC. (US) 2024-04-04 WO disclosed
WO-2023020512-A1 SUBSTITUTED PYRIDINE ANALOGUE, PREPARATION METHOD THEREFOR, AND USE THEREOF AS AHR MODULATOR 成都奥睿药业有限公司 2023-02-23 WO disclosed
EP-3638227-B1 SPIROCYCLIC INDOLINES AS IL-17 MODULATORS UCB Biopharma SRL (BE) 2022-08-10 EP disclosed
US-11136326-B2 Pyrrolopyrimidine derivatives as TAM inhibitors INCYTE CORPORATION (US) 2021-10-05 US disclosed
US-11052076-B2 Spirocyclic indolines as IL-17 modulators UCB Biopharma SRL (BE) 2021-07-06 US disclosed
CN-109748915-B Inhibitors of influenza virus replication and methods of use and uses thereof 广东东阳光药业有限公司 2021-03-26 CN disclosed
US-7598256-B2 Parkinson's disease; antidepressants; cognition activators; attention deficit disorders; narcolepsy; N,N-dimethyl-4-(2-furyl)-1H-pyrrolo[2,3- d]pyrimidine-2-amine VERNALIS RESEARCH LIMITED (GB) 2009-10-06 US disclosed
WO-2009020990-A1 2- [ (2-{PHENYLAMINO}-1H-PYRROLO [2, 3-D] PYRIMIDIN-4-YL) AMINO] BENZAMIDE DERIVATIVES AS IGF-1R INHIBITORS FOR THE TREATMENT OF CANCER SMITHKLINE BEECHAM CORPORATION (US) 2009-02-12 WO disclosed
EP-1363639-B1 PYRROLO 2,3-d PYRIMIDINE AND THEIR USE AS PURINERGIC RECEPTOR ANTAGONISTS VERNALIS RES LTD (GB) 2008-08-20 EP disclosed
US-20080004295-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-01-03 US disclosed
US-20070142402-A1 Kinase Inhibitors And Their Uses RIGEL PHARMACEUTICALS, INC. (US) 2007-06-21 US disclosed
US-7098333-B2 Pyrrolo[2,3-d]pyrimidine and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED (GB) 2006-08-29 US disclosed
US-20060128731-A1 Pyrrolo [2,3-d] pyrimidine and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED 2006-06-15 US disclosed
US-20040092537-A1 Pyrrolo[2,3-d]pyrimidine and their use as purinergic receptor antagonists VERNALIS RESEARCH LIMITED (GB) 2004-05-13 US disclosed
EP-0673376-B1 BICYCLIC PYRIMIDINE COMPOUNDS, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS ADIR (FR) 1996-05-22 EP disclosed
US-5508277-A Bicyclic pyrimidines ADIR ET COMPAGNIE (FR) 1996-04-16 US 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 (7 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-20060128731-A1 Pyrrolo [2,3-d] pyrimidine and their use as purinergic receptor antagonists CHRNA6, CNR1, ADORA2A NPC1 801/4885RAB9A 728/4885MEN1 4873/4885
US-11136326-B2 Pyrrolopyrimidine derivatives as TAM inhibitors FLT3, MERTK, MIF NPC1 3777/4885RAB9A 1615/4885MEN1 2493/4885
US-11052076-B2 Spirocyclic indolines as IL-17 modulators IL17A, IL2, IL18 NPC1 1898/4885RAB9A 2204/4885MEN1 2240/4885
US-20040092537-A1 Pyrrolo[2,3-d]pyrimidine and their use as purinergic receptor antagonists CNR1, CNR2, CHRNA6 NPC1 508/4885RAB9A 876/4885MEN1 4883/4885
US-20080004295-A1 NOVEL COMPOUNDS SYK, BTK, LCK NPC1 3702/4885RAB9A 3261/4885MEN1 4790/4885
US-20070142402-A1 Kinase Inhibitors And Their Uses BTK, SYK, LYN NPC1 4530/4885RAB9A 1164/4885MEN1 2835/4885
US-20240174647-A1 KINASE MODULATORS AND METHODS OF USE THEREOF LRRK2, MAP3K20, MAP3K5 NPC1 2422/4885RAB9A 917/4885MEN1 3663/4885

“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.