SCHEMBL3743779

SCHEMBL3743779

O=c1[nH]c(-c2ccccc2)no1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
RARB P10826 2/20 0.51
ADH5 P11766 1/20 0.50
BTK Q06187 1/20 0.48
PARP1 P09874 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
XDH P47989 1/20 0.44
SLC22A12 Q96S37 1/20 0.44
ALOX5 P09917 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
RARG P13631 1/20 0.43
PLA2G2A P14555 1/20 0.43
NR4A2 P43354 1/20 0.43
CCKBR P32239 2/20 0.43
POLB P06746 1/20 0.43
TNKS O95271 1/20 0.43

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
SCHEMBL4443620 0.96 ALDH1A1 (0.57) ALDH1A1RARBADH5BTKPARP1
SCHEMBL21034046 0.85 LTB4R2 (0.51) ALDH1A1
SCHEMBL31546329 0.82 ALOX5 (0.61) ALDH1A1RARBADH5PARP1MAPT
SCHEMBL2646011 0.82 ALDH1A1 (0.58) ALDH1A1RARBADH5PARP1XDH
SCHEMBL750501 0.80 ALDH1A1 (0.57) ALDH1A1RARBADH5PARP1XDH
SCHEMBL22273714 0.80 ALOX5 (0.63) ALDH1A1RARBADH5PARP1XDH
SCHEMBL15059787 0.80 ALDH1A1 (0.57) ALDH1A1RARBADH5PARP1XDH
SCHEMBL2646013 0.80 ALDH1A1 (0.57) ALDH1A1RARBADH5PARP1XDH
SCHEMBL16645310 0.80 ALDH1A1 (0.57) ALDH1A1RARBADH5PARP1XDH
SCHEMBL2963261 0.80 ALDH1A1 (0.61) ALDH1A1RARBADH5PARP1XDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4562016-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed
US-12275723-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2025-04-15 US disclosed
US-20240400546-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-12-05 US disclosed
US-20240300938-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-09-12 US disclosed
US-11970486-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-04-30 US disclosed
US-20240124435-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-04-18 US disclosed
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 CN disclosed
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
WO-2007039178-A2 PHENYL-[1,2,4]-OXADIAZOL-5-ONE DERIVATIVES WITH PHENYL GROUP, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (DE) 2007-04-12 WO disclosed
US-20050164954-A1 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. 2005-07-28 US disclosed
US-6900207-B2 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-31 US disclosed
US-20030153508-A1 Nitrogen-containing 5-membered cyclic compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2003-08-14 US disclosed
EP-0975220-B1 USE OF SULFONYLOXADIAZOLONES AS MICROBICIDES BAYER CROPSCIENCE AG (DE) 2003-04-02 EP disclosed
EP-1254901-A1 NITROGEN-CONTAINING 5-MEMBERED CYCLIC COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-11-06 EP disclosed
US-6090831-A FUNGICIDE; BACTERICIDE BAYER AKTIENGESELLSCHAFT (DE) 2000-07-18 US disclosed
EP-0975220-A1 USE OF SULFONYLOXADIAZOLONES AS MICROBICIDES BAYER AG (DE) 2000-02-02 EP disclosed
WO-1998047369-A1 USE OF SULFONYLOXADIAZOLONES AS MICROBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-10-29 WO disclosed
US-4130571-A Process for preparing 1,2-diacyl-3-glycerylphosphorylcholines NIPPON SHOJI KAISHA, LTD. (JP) 1978-12-19 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 (8 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-20240124435-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885
US-20240300938-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885
US-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885
US-20240400546-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885
US-12275723-B2 Compounds and uses thereof NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885
US-20050164954-A1 N-containing five-membered ring compounds and pharmaceutical agents comprising the same as active ingredient ACIN1, CASP7, CASP10 ALDH1A1 3847/4885RARB 1769/4885ADH5 2610/4885
US-20030153508-A1 Nitrogen-containing 5-membered cyclic compounds and drugs containing these compounds as the active ingredient ACIN1, CASP7, CASP10 ALDH1A1 3366/4885RARB 2896/4885ADH5 2583/4885
US-11970486-B2 Compounds and uses thereof NLN, ACHE, CLN6 ALDH1A1 656/4885RARB 3163/4885ADH5 1249/4885

“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.