SCHEMBL6993884

SCHEMBL6993884

N#Cc1c(Nc2ccccc2[N+](=O)[O-])sc2cc(F)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPAS1 Q99814 1/20 0.43
MAPK10 P53779 1/20 0.41
ALDH1A1 P00352 5/20 0.40
MAPK1 P28482 4/20 0.40
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CASP7 P55210 1/20 0.40
MAPT P10636 5/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RAB9A P51151 1/20 0.38
GAA P10253 2/20 0.37
PKM P14618 1/20 0.37
POLB P06746 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.36
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.34
ATM Q13315 1/20 0.34
CUL4A Q13619 1/20 0.34

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
SCHEMBL7000491 0.91 ATM (0.38) EPAS1MAPK10ALDH1A1MAPK1TDP1
SCHEMBL4845280 0.87 KCNMA1 (0.41) EPAS1MAPK10ALDH1A1MAPK1TDP1
SCHEMBL4840460 0.87 TDP1 (0.37) EPAS1MAPK10ALDH1A1MAPK1TDP1
SCHEMBL6992038 0.87 L3MBTL1 (0.43) EPAS1ALDH1A1MAPK1TDP1L3MBTL1
SCHEMBL6995064 0.86 KAT2B (0.36) ALDH1A1MAPK1TDP1MAPTMEN1
SCHEMBL4879805 0.86 MAPK1 (0.46) EPAS1ALDH1A1MAPK1TDP1L3MBTL1
SCHEMBL6994349 0.81 AKR1C3 (0.40) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL4837176 0.79 HTT (0.38) EPAS1ALDH1A1MAPK1TDP1L3MBTL1
SCHEMBL4839033 0.75 MAPK1 (0.47) EPAS1ALDH1A1MAPK1L3MBTL1MAPT
SCHEMBL6990160 0.74 MAPT (0.44) ALDH1A1MAPK1TDP1L3MBTL1CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1016664-B1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI PHARMA CORP (JP) 2003-07-02 EP disclosed
US-6455521-B1 PSYCHOLOGICAL DISORDERS; SIDE EFFECT REDUCTION MITSUBISHI PHARMA CORPORATION (JP) 2002-09-24 US disclosed
US-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2002-04-11 US disclosed
US-6271225-B1 PSYCHOLOGICAL DISORDERS WELFIDE CORPORATION (JP) 2001-08-07 US disclosed
EP-1016664-A1 FUSED THIOPHENE COMPOUNDS AND MEDICINAL USE THEREOF YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2000-07-05 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 (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-20020042411-A1 Condensed thiophene compounds and pharmaceutical use thereof ACIN1, ACHE, TPMT EPAS1 3357/4885MAPK10 2737/4885ALDH1A1 366/4885

“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.