SCHEMBL15217593

SCHEMBL15217593

CC(C)(C)OC(=O)Cc1n[nH]c(=O)c2ncnnc12

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.32
TNKS O95271 1/20 0.32
APLNR P35414 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
PARP1 P09874 2/20 0.31
LMNA P02545 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
SCHEMBL15217600 0.95 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1MAPTHPGDAPLNR
SCHEMBL361109 0.84 SMN1; SMN2 (0.41) SMN1; SMN2ALDH1A1MAPTHPGDTNKS
SCHEMBL18867571 0.81 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1HPGDLMNA
SCHEMBL15217613 0.79 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPTHPGDTNKS
SCHEMBL15217622 0.79 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPTHPGDPRMT5
SCHEMBL15217609 0.79 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPTHPGDTNKS
SCHEMBL15217619 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1MAPTHPGDPRMT5
SCHEMBL9378653 0.74 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1HPGDTNKSPARP1
SCHEMBL9377801 0.74 SMN1; SMN2 (0.51) SMN1; SMN2ALDH1A1HPGDTNKSPARP1
SCHEMBL15217604 0.74 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTHPGDPRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11730737-B2 Aldose reductase inhibitors and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2023-08-22 US disclosed
US-20170319584-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-11-09 US disclosed
US-20170216291-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2017-08-03 US disclosed
US-20170216292-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-08-03 US disclosed
US-9650383-B2 Aldose reductase inhibitors and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-05-16 US disclosed
US-20150072989-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-03-12 US disclosed
US-8916563-B2 Aldose reductase inhibitors and uses thereof THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2014-12-23 US disclosed
US-20130225592-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2013-08-29 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 (6 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-20170216291-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885
US-20170319584-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885
US-20170216292-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885
US-20150072989-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885
US-20130225592-A1 ALDOSE REDUCTASE INHIBITORS AND USES THEREOF ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885
US-11730737-B2 Aldose reductase inhibitors and uses thereof ALDOA, AKR1B1, AKR1C2 SMN1; SMN2 2204/4885ALDH1A1 18/4885MAPT 1238/4885

“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.