SCHEMBL240979

SCHEMBL240979

CSc1ncnc2[nH]cnc12

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
MAP3K5 Q99683 1/20 0.40
G6PD P11413 1/20 0.37
TSHR P16473 2/20 0.35
CYP1A2 P05177 1/20 0.35
CDC7 O00311 2/20 0.35
DBF4 Q9UBU7 2/20 0.35
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PAK1 Q13153 1/20 0.33
NOTUM Q6P988 2/20 0.32
DRD3 P35462 1/20 0.31
PI4KA P42356 1/20 0.31
XDH P47989 1/20 0.31
LRRK2 Q5S007 1/20 0.31
PI4K2B Q8TCG2 1/20 0.31
PI4K2A Q9BTU6 1/20 0.31
PI4KB Q9UBF8 1/20 0.31

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
SCHEMBL2888984 0.83 G6PD (0.48) TP53HSD17B10G6PDTSHRCDC7
SCHEMBL1884552 0.80 G6PD (0.37) TP53HSD17B10G6PDLMNAPAK1
SCHEMBL2115552 0.79 PAK1 (0.40) TP53HSD17B10G6PDTSHRCYP1A2
SCHEMBL754882 0.79 ALDH1A1 (0.39) TP53HSD17B10G6PDTSHRALDH1A1
SCHEMBL2888365 0.77 G6PD (0.35) TP53HSD17B10G6PDCDC7DBF4
SCHEMBL2118555 0.77 PAK1 (0.48) TP53HSD17B10TSHRCYP1A2CDC7
SCHEMBL31186595 0.76 CDC7 (0.64) HSD17B10CYP1A2CDC7DBF4LMNA
SCHEMBL21639749 0.76 CDC7 (0.64) HSD17B10CYP1A2CDC7DBF4LMNA
SCHEMBL130799 0.76 MAP3K5 (0.56) TP53HSD17B10MAP3K5CYP1A2ALDH1A1
SCHEMBL763254 0.74 MAP3K5 (0.39) TP53HSD17B10MAP3K5CYP1A2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250076302-A1 DETECTING THE PRESENCE OF URINARY STONE DISEASE USING A PLURALITY OF URINARY METABOLITES THE CLEVELAND CLINIC FOUNDATION 2025-03-06 US claimed
CN-118931997-A Method for synthesizing adenosine and/or uridine by three-enzyme cascade catalysis 上海飞腾医药科技有限公司 2024-11-12 CN claimed
US-20240368505-A1 FLUORINE-FREE CLEANING AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF Tan Kah Kee Innovation Laboratory (CN) 2024-11-07 US claimed
CN-118879891-A Method for evaluating PE (polyethylene) based on intestinal flora 广州市番禺区妇幼保健院(广州市番禺区何贤纪念医院) 2024-11-01 CN claimed
CN-116731798-A Fluorine-free cleaning agent, and preparation method and application thereof 嘉庚创新实验室 2023-09-12 CN claimed
WO-2023133876-A1 FLUORINE-FREE CLEANING AGENT, PREPARATION METHOD THEREFOR AND USE THEREOF 嘉庚创新实验室 2023-07-20 WO claimed
CN-114317127-B Fluorine-free cleaning agent, and preparation method and application thereof 嘉庚创新实验室 2023-07-04 CN claimed
CN-115943307-A MR1 ligands and pharmaceutical compositions for immunomodulation 巴塞尔大学 2023-04-07 CN claimed
CN-114558061-B Loquat leaf extract and preparation method and application thereof 浙江大学 2023-04-04 CN claimed
US-20230099822-A1 MR1 LIGANDS AND PHARMACEUTICAL COMPOSITIONS FOR IMMUNOMODULATION UNIVERSITÄT BASEL (CH) 2023-03-30 US claimed
US-20040014722-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases BIOCRYST PHARMACEUTICALS, INC. 2004-01-22 US claimed
WO-2003105862-A1 IN-VIVO ENERGY DEPLETING STRATEGIES FOR KILLING DRUG-RESISTANT CANCER CELLS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2003-12-24 WO claimed
WO-2003076894-A2 A RAPID IMMUNOCHEMICAL PROCESS FOR MEASURING THIOPURINE METHYLTRANSFERASE REACTION PRODUCTS BIOLOGIX DIAGNOSTICS, LLC (US) 2003-09-18 WO claimed
US-20030170764-A1 Rapid, immunochemical process for measuring thiopurine methyltransferase BIOLOGIX DIAGNOSTICS, LLC 2003-09-11 US claimed
US-5733915-A CORTICOIDS AND AZATHIOPRINE GLAXO WELLCOME INC. (US) 1998-03-31 US claimed
US-RE35558-E (2R)-2-[di(2-propyl)phosphonyylmethoxy]-3-P-toluenesulfonyloxy-1-trimethylacetoxypropane, its preparation and use INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1997-07-08 US claimed
US-5438130-A Fucosylated guanosine disulfates as excitatory amino acid antagonists CAMBRIDGE NEUROSCIENCE, INC. (US) 1995-08-01 US claimed
US-5352786-A Di(2-propyl)esters of 1-fluoro-2-phosphonomethoxy-3-P-to-luenesulfonyloxypropanes, their producing and utilization INSTITUTE OF ORGANIC CHEMISTRY AND BIOCHEMISTRY OF THE ACADEMY OF SCIENCES OF THE CZECH REPUBLIC (CS) 1994-10-04 US claimed
WO-1994015622-A1 NUCLEOSIDE DERIVATIVES AND THEIR USE AS EXCITATORY AMINO ACID ANTAGONISTS CAMBRIDGE NEUROSCIENCE (US) 1994-07-21 WO claimed
EP-0044928-B1 1,4;3,6-DIANHYDRO-HEXITE-NITRATE SUBSTITUTED BY PURINE BASES, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL COMPOSITIONS Dr. Willmar Schwabe GmbH & Co. (DE) 1985-03-13 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20040014722-A1 Nucleosides, preparation thereof and use as inhibitors of RNA viral polymerases NSUN2, POLR2H, NSUN3 TP53 2728/4885HSD17B10 1289/4885MAP3K5 4429/4885
US-20230099822-A1 MR1 LIGANDS AND PHARMACEUTICAL COMPOSITIONS FOR IMMUNOMODULATION MRGPRX1, MRGPRX2, CD47 TP53 645/4885HSD17B10 3818/4885MAP3K5 3347/4885

“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.