SCHEMBL4126987

SCHEMBL4126987

Nc1ncnc2c1nc(I)n2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA8 P11142 3/20 0.80
HSPA5 P11021 2/20 0.80
RXFP1 Q9HBX9 1/20 0.76
GAPDH P04406 3/20 0.69
HSD17B10 Q99714 1/20 0.69
SMN1; SMN2 Q16637 2/20 0.68
LMNA P02545 1/20 0.68
TP53 P04637 1/20 0.68
HBB P68871 1/20 0.68
ADORA3 P0DMS8 3/20 0.64
ADK P55263 1/20 0.64
AMD1 P17707 1/20 0.64
SLC28A2 O43868 2/20 0.63
DPP4 P27487 1/20 0.63
MEN1 O00255 1/20 0.63
SLC28A1 O00337 1/20 0.63
MAP3K7 O43318 1/20 0.63
MAPK1 P28482 1/20 0.63
ADORA2A P29274 1/20 0.63
ADORA2B P29275 1/20 0.63

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
SCHEMBL4126993 1.00 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL1145052 0.89 HSPA8 (1.00) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL17412455 0.89 HSPA8 (1.00) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL1145049 0.89 HSPA8 (1.00) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL6305168 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL18858928 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL15906300 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL1135195 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL5362344 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10
SCHEMBL15906323 0.88 HSPA8 (0.80) HSPA8HSPA5RXFP1GAPDHHSD17B10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-121678872-A Method for detecting iodo-nucleoside in drinking water by solid phase extraction-vacuum centrifugal concentration-liquid chromatography tandem mass spectrometry 浙江大学 2026-03-17 CN disclosed
US-8946188-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2015-02-03 US disclosed
WO-2014128289-A1 BIOMEDICAL DEVICE IMPLANTABLE IN BONE AND/OR CARTILAGINOUS TISSUE, AND CORRESPONDING METHOD TO MANUFACTURE SAID BIOMEDICAL DEVICE LUMETTI, SIMONE (IT) 2014-08-28 WO disclosed
US-20140024611-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-01-23 US disclosed
US-8461128-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2013-06-11 US disclosed
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-07-02 US disclosed
WO-2006113615-A2 ANTI-MICROBIAL AGENTS AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2006-10-26 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 (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-20140024611-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF ACAT1, ACAT2, APEH HSPA8 513/4885HSPA5 1808/4885RXFP1 1943/4885
US-20090170805-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF ACAT1, ACAT2, APEH HSPA8 513/4885HSPA5 1808/4885RXFP1 1943/4885

“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.