SCHEMBL2335910

SCHEMBL2335910

CCOc1ccccc1NC(=S)NC(=O)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.76
POLB P06746 1/20 0.68
KCNH2 Q12809 1/20 0.68
TDP1 Q9NUW8 1/20 0.66
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
ALDH1A1 P00352 5/20 0.60
MAPT P10636 4/20 0.60
KDM4E B2RXH2 2/20 0.60
GAA P10253 2/20 0.60
ALOX12 P18054 2/20 0.60
HPGD P15428 1/20 0.60
MAPK1 P28482 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
CYP2C19 P33261 1/20 0.56

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
SCHEMBL16119627 0.90 EPHX1 (0.62) EPHX1POLBKCNH2TDP1MEN1
SCHEMBL2344070 0.89 POLB (0.61) EPHX1POLBKCNH2TDP1MEN1
SCHEMBL8970981 0.86 PTK2 (0.70) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL16119541 0.84 EPHX1 (0.56) EPHX1POLBKCNH2TDP1MEN1
SCHEMBL8296751 0.84 EPHX1 (0.68) EPHX1POLBKCNH2TDP1MEN1
SCHEMBL24506879 0.83 EPHX1 (0.67) EPHX1POLBKCNH2TDP1MEN1
SCHEMBL10393407 0.82 ALDH1A1 (0.82) POLBKCNH2TDP1MEN1KMT2A
SCHEMBL16119707 0.81 EPHX1 (0.62) EPHX1MEN1KMT2AALDH1A1MAPT
SCHEMBL6118209 0.81 EPHX1 (0.78) EPHX1MEN1KMT2AALDH1A1MAPT
SCHEMBL11105097 0.81 EPHX1 (0.66) EPHX1TDP1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2536286-A1 INHIBITORS AND METHODS OF INHIBITING BACTERIAL AND VIRAL PATHOGENS Siga Technologies, Inc. (US) 2012-12-26 EP claimed
WO-2011103375-A1 INHIBITORS AND METHODS OF INHIBITING BACTERIAL AND VIRAL PATHOGENS SIGA TECHNOLOGIES, INC. (US) 2011-08-25 WO claimed
EP-3173414-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Biosciences Inc. (US) 2017-05-31 EP disclosed
EP-2188271-B1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC (US) 2017-01-11 EP disclosed
EP-2536719-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS Acea Biosciences, Inc. (US) 2012-12-26 EP disclosed
US-8252822-B2 Heterocyclic compounds and uses as anticancer agents ACEA BIOSCIENCES, INC. (US) 2012-08-28 US disclosed
US-20110207751-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Therapeutics, Inc. 2011-08-25 US disclosed
WO-2011103509-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC. (US) 2011-08-25 WO disclosed
EP-2188271-A2 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS Acea Biosciences, Inc. (US) 2010-05-26 EP disclosed
WO-2009023402-A2 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA BIOSCIENCES INC. (US) 2009-02-19 WO disclosed
US-20090048271-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS ACEA Therapeutics, Inc. 2009-02-19 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 (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-20090048271-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS MKI67, CCNC, HCCS EPHX1 1565/4885POLB 481/4885KCNH2 4025/4885
US-20110207751-A1 HETEROCYCLIC COMPOUNDS AND USES AS ANTICANCER AGENTS MKI67, CCNC, NUDC EPHX1 2075/4885POLB 521/4885KCNH2 4123/4885

“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.