SCHEMBL2335759

SCHEMBL2335759

CC(=O)Nc1ccc2scnc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.62
KDM4E B2RXH2 3/20 0.55
MEN1 O00255 4/20 0.54
NPC1 O15118 4/20 0.54
RAB9A P51151 4/20 0.54
KMT2A Q03164 4/20 0.54
MAPT P10636 3/20 0.54
GLA P06280 1/20 0.54
TNNI3 P19429 1/20 0.54
TNNT2 P45379 1/20 0.54
TNNC1 P63316 1/20 0.54
RUNX1 Q01196 1/20 0.54
CBFB Q13951 1/20 0.54
AURKA O14965 1/20 0.53
HIF1A Q16665 1/20 0.53
PABPC1 P11940 1/20 0.51
ALDH1A1 P00352 2/20 0.50
LDHA P00338 2/20 0.50
KEAP1 Q14145 1/20 0.50
NFE2L2 Q16236 1/20 0.50

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
SCHEMBL8863163 0.87 LDHA (0.57) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL22341666 0.85 HSD11B1 (0.63) HSD11B1KDM4EMEN1NPC1RAB9A
SCHEMBL13076421 0.84 HSD11B1 (0.55) HSD11B1AURKAHIF1AALDH1A1KEAP1
SCHEMBL6653400 0.83 HSD11B1 (0.58) HSD11B1MEN1NPC1RAB9AKMT2A
SCHEMBL9508191 0.83 HSD11B1 (0.58) HSD11B1MAPTAURKAHIF1AALDH1A1
SCHEMBL11770138 0.80 HSD11B1 (0.58) HSD11B1MEN1NPC1RAB9AKMT2A
SCHEMBL18180168 0.80 HSD11B1 (0.54) HSD11B1MEN1NPC1RAB9AKMT2A
SCHEMBL8861663 0.78 NPC1 (0.53) HSD11B1KDM4EMEN1NPC1RAB9A
SCHEMBL5803760 0.78 HSD11B1 (0.65) HSD11B1MEN1NPC1RAB9AKMT2A
SCHEMBL13006762 0.78 ALDH1A1 (0.50) HSD11B1AURKAHIF1AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429993-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INT (DE) 2015-01-21 EP disclosed
US-8841331-B2 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. (US) 2014-09-23 US disclosed
US-8338441-B2 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. (US) 2012-12-25 US disclosed
US-8338441-B2 Inhibitors of human immunodeficiency virus replication GILEAD SCIENCES, INC. (US) 2012-12-25 US disclosed
EP-1465882-B1 HETROCYCLIC MODULATORS OF NUCLEAR RECEPTORS X CEPTOR THERAPEUTICS INC (US) 2011-08-24 EP disclosed
WO-2010130034-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-11-18 WO disclosed
US-20100292227-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2010-11-18 US disclosed
US-20100292227-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2010-11-18 US disclosed
EP-1211555-B1 Silver halide photographic emulsion and silver halide photographic material containing said silver halide photographic emulsion FUJIFILM CORP (JP) 2008-12-31 EP disclosed
US-7115640-B2 Heterocyclic modulators of nuclear receptors X-CEPTOR THERAPEUTICS, INC. (US) 2006-10-03 US disclosed
EP-0367243-A1 A silver halide photographic light-sensitive material excellent in antistatic property KONICA CORPORATION (JP) 1990-05-09 EP disclosed
US-4917997-A MIXED WITH ASCORBIC ACID COMPONENT, SENSITIZING DYE, BISAMINOSTILBENE WITH PYRIMIDINE SUBSTITUTION FUJI PHOTO FILM CO., LTD. (JP) 1990-04-17 US disclosed
EP-0357082-A2 Silver halide photographic emulsions FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed
US-4308345-A CYANINE DYES FOR COLOR FUJI PHOTO FILM CO., LTD. (JP) 1981-12-29 US disclosed
US-4307185-A SENSITIZING DYE OF CYANINE STRUCTURE FUJI PHOTO FILM CO., LTD. (JP) 1981-12-22 US disclosed
US-4212672-A CYANINE SENSITIZER DYE, SULFONIC ACID-SUBSTITUTED HETEROCYCLIC COMPOUND, POLYOXYALKYLENE OXIDE FUJI PHOTO FILM CO., LTD. (JP) 1980-07-15 US disclosed
US-4121935-A CARBOCYANINE DYES KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1978-10-24 US disclosed
US-4047964-A BENZISOXAZOLE FUJI PHOTO FILM CO., LTD. (JA) 1977-09-13 US disclosed
US-4040841-A SENSITIZING DYE FUJI PHOTO FILM CO., LTD. (JA) 1977-08-09 US disclosed
US-4018610-A Supersensitized silver halide photographic emulsion FUJI PHOTO FILM CO., LTD. (JA) 1977-04-19 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 (1 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-20100292227-A1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION RTF2, REV1, RTF1 HSD11B1 2249/4885KDM4E 1453/4885MEN1 3840/4885

“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.