SCHEMBL1245666

SCHEMBL1245666

c1ccc(-c2ccon2)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.61
LMNA P02545 3/20 0.61
CCR1 P32246 3/20 0.61
CCR5 P51681 3/20 0.61
CCR8 P51685 3/20 0.61
POLB P06746 2/20 0.61
CYP1A2 P05177 2/20 0.61
METAP1 P53582 1/20 0.61
BLM P54132 1/20 0.61
HIF1A Q16665 1/20 0.61
DOHH Q9BU89 1/20 0.61
P4HTM Q9NXG6 1/20 0.61
NPC1 O15118 9/20 0.52
RAB9A P51151 9/20 0.52
TP53 P04637 6/20 0.52
SMN1; SMN2 Q16637 6/20 0.52
HTT P42858 4/20 0.52
PKM P14618 3/20 0.52
HSD17B10 Q99714 3/20 0.52
ALDH1A1 P00352 3/20 0.52

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
SCHEMBL30564803 1.00 KDM4E (0.61) KDM4ELMNACCR1CCR5CCR8
SCHEMBL28934089 0.86
Dipyridyl SCHEMBL809479 0.78 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
SCHEMBL1181563 0.78 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL9299834 0.78 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL8685663 0.78 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL7732129 0.78 KDM4E (0.88) KDM4ELMNACCR1CCR5CCR8
SCHEMBL3082762 0.78 NPC1 (0.42) KDM4EPOLBCYP1A2NPC1RAB9A
Dipyridyl SCHEMBL3711450 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8
Dipyridyl SCHEMBL29351528 0.78 KDM4E (1.00) KDM4ELMNACCR1CCR5CCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105586030-A Organic Light-Emitting Device SAMSUNG DISPLAY CO LTD 2016-05-18 CN claimed
CN-102369200-A Derivatives of azaspiranyl-alkylcarbamates of 5-member heterocyclic compounds, preparation thereof and therapeutic use thereof SANOFI SA 2012-03-07 CN claimed
CN-102216291-A Carbamate derivatives containing alkyl-heterocycles, preparation and therapeutic use thereof SANOFI AVENTIS 2011-10-12 CN claimed
CN-102164920-A Alkylthiazole carbamate derivatives, method for the production thereof and use thereof as FAAH enzyme inhibitors SANOFI AVENTIS 2011-08-24 CN claimed
CN-101959884-A 6-heterocyclic imidazo [1, 2-alpha ] pyridine-2-carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS 2011-01-26 CN claimed
CN-101918409-A The diazabicycloalkane derivatives of biaryl substituted ABBOTT LAB 2010-12-15 CN claimed
CN-100497326-C 1-piperazine-and 1-homopiperazine-carboxylate derivatives, preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2009-06-10 CN claimed
CN-101351495-A fatty acid amide hydrolase inhibitors ORGANON NV (NL) 2009-01-21 CN claimed
CN-1968950-A Pyridinylisoxazole compounds and their use as herbicides BAYER CROPSCIENCE GMBH (DE) 2007-05-23 CN claimed
EP-1758896-A1 PYRIDINYL-ISOXAZOLES AND THEIR USE AS HERBICIDES Bayer CropScience GmbH (DE) 2007-03-07 EP claimed
WO-2005123726-A1 PYRIDINYL-ISOXAZOLES AND THEIR USE AS HERBICIDES BAYER CROPSCIENCE GMBH (DE) 2005-12-29 WO claimed
US-20050282707-A1 Pyridinylisoxazoles and their use as herbicides BAYER CROPSCIENCE GMBH (DE) 2005-12-22 US claimed
CN-114450271-B Ureas, amino and substituted heteroaryl compounds for Cbl-b inhibition 纽力克斯治疗公司 2024-09-20 CN disclosed
US-20230271941-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-08-31 US disclosed
US-11576914-B2 Drug for treating or preventing disorder caused by TGF-β signaling, and application thereof THE DOSHISHA (JP) 2023-02-14 US disclosed
US-11576914-B2 Drug for treating or preventing disorder caused by TGF-β signaling, and application thereof THE DOSHISHA (JP) 2023-02-14 US disclosed
WO-2001019821-A1 BENZISOXAZOLYL-, PYRIDOISOXAZOLYL- AND BENZTHIENYL-PHENOXY DERIVATIVES USEFUL AS D4 ANTAGONISTS AVENTIS PHARMACEUTICALS INC. (US) 2001-03-22 WO disclosed
CN-1241184-A Indole derivatives for the treatment of osteoporosis SMITHKLINE BEECHAM SPA (IT) 2000-01-12 CN disclosed
CN-1200117-A Phenylacetic acids, processes for their preparation and agents containing them BASF AG (DE) 1998-11-25 CN disclosed
CN-1177957-A Indole derivatives for the treatment of osteoporosis SMITHKLINE BEECHAM SPA (IT) 1998-04-01 CN 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 (3 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-20230271941-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 KDM4E 3761/4885LMNA 2339/4885CCR1 2064/4885
US-11576914-B2 Drug for treating or preventing disorder caused by TGF-β signaling, and application thereof TGFBR1, FIBP, TGFB1 KDM4E 991/4885LMNA 2922/4885CCR1 939/4885
US-20050282707-A1 Pyridinylisoxazoles and their use as herbicides PRDX1, CYP4X1, PRDX4 KDM4E 2037/4885LMNA 2335/4885CCR1 3970/4885

“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.