SCHEMBL8745820

SCHEMBL8745820

COc1ccc(Cn2nn[nH]c2=S)cc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.55
GFER P55789 1/20 0.55
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 8/20 0.46
BLM P54132 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SIGMAR1 Q99720 1/20 0.45
MAPT P10636 3/20 0.45
ALOX15 P16050 1/20 0.45
CMA1 P23946 1/20 0.45
PKM P14618 2/20 0.44
NPBWR1 P48145 1/20 0.43
MPI P34949 2/20 0.43
APOBEC3G Q9HC16 2/20 0.43
GSK3A P49840 1/20 0.42
GSK3B P49841 1/20 0.42
TOP2A P11388 1/20 0.42

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
SCHEMBL29922845 0.83 CMA1 (0.51) GAAGFERKDM4EMEN1KMT2A
SCHEMBL2034751 0.78 KDM4E (0.49) GAAGFERKDM4EALDH1A1SIGMAR1
SCHEMBL18757774 0.74 ALDH1A1 (0.45) GAAGFERKDM4EMEN1KMT2A
SCHEMBL1247788 0.73 HPGD (0.47) GAAKDM4EMEN1KMT2AALDH1A1
SCHEMBL18377688 0.69 ALDH1A1 (0.54) GAAGFERKDM4EMEN1KMT2A
SCHEMBL19732308 0.69 ALDH1A1 (0.54) GAAKDM4EMEN1KMT2AALDH1A1
SCHEMBL1768224 0.69 ALDH1A1 (0.54) GAAKDM4EMEN1KMT2AALDH1A1
SCHEMBL30946374 0.69 TOP2A (0.52) KDM4EALDH1A1SIGMAR1MAPTALOX15
SCHEMBL7684043 0.69 ALDH1A1 (0.54) GAAKDM4EALDH1A1MAPTALOX15
SCHEMBL14987051 0.68 PDE8B (0.46) GAAGFERKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10729738-B2 Hindered disulfide drug conjugates GENENTECH, INC. (US) 2020-08-04 US disclosed
US-20170112891-A1 HINDERED DISULFIDE DRUG CONJUGATES GENENTECH INC (US) 2017-04-27 US disclosed
US-20170112891-A1 HINDERED DISULFIDE DRUG CONJUGATES GENENTECH INC (US) 2017-04-27 US disclosed
WO-2017064675-A1 HINDERED DISULFIDE DRUG CONJUGATES GENENTECH, INC. (US) 2017-04-20 WO disclosed
EP-0636934-B1 Photographic elements comprising 2-phenylcarbamoyl-1-naphthol image-modifying couplers yielding dyes resistant to crystallization and reduction EASTMAN KODAK CO (US) 1997-02-19 EP disclosed
US-5514530-A IMPROVED COLOR DENSITY, COLOR NEGATIVE FILMS EASTMAN KODAK COMPANY (US) 1996-05-07 US disclosed
EP-0348139-B1 Photograhic materials and process EASTMAN KODAK CO (US) 1995-07-19 EP disclosed
EP-0347850-B1 Photographic material having combination of releasable compounds EASTMAN KODAK CO (US) 1995-03-29 EP disclosed
EP-0636934-A1 Photographic elements comprising 2-phenylcarbamoyl-1-naphthol image-modifying couplers yielding dyes resistant to crystallization and reduction EASTMAN KODAK COMPANY (US) 1995-02-01 EP disclosed
US-4962018-A TIMED RELEASE DEVELOPMENT INHIBITOR EASTMAN KODAK COMPANY (US) 1990-10-09 US disclosed
US-4912024-A Mixture of couplers EASTMAN KODAK COMPANY (US) 1990-03-27 US disclosed
EP-0348139-A2 Photograhic materials and process EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1989-12-27 EP 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-10729738-B2 Hindered disulfide drug conjugates STS, TST, SCLY GAA 2778/4885GFER 24/4885KDM4E 3411/4885
US-20170112891-A1 HINDERED DISULFIDE DRUG CONJUGATES STS, TST, SCLY GAA 2778/4885GFER 24/4885KDM4E 3411/4885

“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.