SCHEMBL857098

SCHEMBL857098

CSc1nc(Cl)c2c(n1)CCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
GAA P10253 3/20 0.44
HTT P42858 2/20 0.42
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
HTR2B P41595 2/20 0.40
LMNA P02545 3/20 0.37
MAPK1 P28482 2/20 0.37
NSD2 O96028 1/20 0.37
ACHE P22303 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 1/20 0.36
BPTF Q12830 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 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
SCHEMBL857447 0.80 L3MBTL1 (0.43) KMT2AGAAHTTLMNAMAPK1
SCHEMBL4908625 0.77 KMT2A (0.43) KMT2AGAAHTTLMNAMAPK1
SCHEMBL11307009 0.77 ABCB1 (0.47) KMT2AGAAHTTLMNAMAPK1
SCHEMBL7415814 0.77 L3MBTL1 (0.46) KMT2AGAAHTTLMNAMAPK1
SCHEMBL4899939 0.76 HTR2A (0.38) KMT2AHTR2AHTR2CHTR2BMAPK1
SCHEMBL8099775 0.76 KMT2A (0.48) KMT2AGAAHTTHTR2CLMNA
SCHEMBL19948025 0.75 HTR2A (0.44) KMT2AGAAHTR2AHTR2CHTR2B
SCHEMBL16637692 0.75 HTR2A (0.38) KMT2AGAAHTTHTR2AHTR2C
SCHEMBL1101904 0.74 KDM4E (0.55) KMT2AGAAHTTLMNAACHE
SCHEMBL3797050 0.74 PDK1 (0.37) KMT2AGAAHTTHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12264169-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners (US) 2025-04-01 US disclosed
EP-4434982-A1 (S)-2-(2-METHYLAZETIDIN-1-YL)PYRIMIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME LG Chem, Ltd. (KR) 2024-09-25 EP disclosed
CN-118414332-A (S) -2- (2-methylazetidin-1-yl) pyrimidine derivatives and pharmaceutical compositions containing the same 株式会社LG化学 2024-07-30 CN disclosed
US-20240067633-A1 KETOHEXOKINASE INHIBITOR AND USE THEREOF XIZANG HAISCO PHARMACEUTICAL CO., LTD. (CN) 2024-02-29 US disclosed
CN-117440954-A Metabolic stable pyrimidinyl dihydroquinoxalinones as tubulin polymerization inhibitors 田纳西大学研究基金会 2024-01-23 CN disclosed
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2023-11-02 US disclosed
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2023-11-02 US disclosed
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2023-11-02 US disclosed
EP-4269404-A1 KETOHEXOKINASE INHIBITOR AND USE THEREOF Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2023-11-01 EP disclosed
US-11767334-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2023-09-26 US disclosed
US-20080113946-A1 N-aryl-5,7-dihydrofuro[3,4-d]pyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYNTOVIA, INC. (US) 2008-05-15 US disclosed
EP-1110952-B9 Carboxylic acid derivatives, their preparation and use ABBOTT GMBH & CO KG (DE) 2004-12-15 EP disclosed
EP-1110952-B1 Carboxylic acid derivatives, their preparation and use ABBOTT GMBH & CO KG (DE) 2004-09-29 EP disclosed
EP-0785926-B1 CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MEDICAMENTS BASF AG (DE) 2001-08-22 EP disclosed
EP-1110952-A1 Carboxylic acid derivates, their preparation and use BASF AKTIENGESELLSCHAFT (DE) 2001-06-27 EP disclosed
US-6030975-A ANTAGONIST OF ENDOTHELINS, I.E. INHIBITION OF BINDING WITH RECEPTOR; ANTITUMOR AND -CARCINOGENIC AGENTS; SIDE EFFECT REDUCTION BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
EP-0969841-A1 USE OF CARBOXYLIC ACID DERIVATIVES FOR TREATING CANCER BASF AKTIENGESELLSCHAFT (DE) 2000-01-12 EP disclosed
WO-1998041206-A1 NOVEL CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND USE IN TREATING CANCER BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed
EP-0785926-A1 NEW CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1997-07-30 EP disclosed
WO-1996011914-A1 NEW CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1996-04-25 WO 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 (5 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-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C KMT2A 3408/4885GAA 497/4885HTT 3207/4885
US-11767334-B2 Heteroaryl inhibitors of PDE4 PDE4A, PDE4B, PDE4C KMT2A 3408/4885GAA 497/4885HTT 3207/4885
US-12264169-B2 Heteroaryl inhibitors of PDE4 PDE4A, PDE4B, PDE4C KMT2A 3408/4885GAA 497/4885HTT 3207/4885
US-20080113946-A1 N-aryl-5,7-dihydrofuro[3,4-d]pyrimidin-4-amines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP7, API5, CASP5 KMT2A 2999/4885GAA 2399/4885HTT 1568/4885
US-20240067633-A1 KETOHEXOKINASE INHIBITOR AND USE THEREOF KHK, GCK, HK1 KMT2A 1247/4885GAA 179/4885HTT 776/4885

“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.