SCHEMBL17145353

SCHEMBL17145353

CCOCCNC(=O)CS

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.42
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 3/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
THRB P10828 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PCNA P12004 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL16309409 0.84 SMN1; SMN2 (0.44) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL10304153 0.83 MEN1 (0.56) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL14546558 0.82 EPHX2 (0.57) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL13073508 0.81 SMN1; SMN2 (0.42) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL23677003 0.81 ALDH1A1 (0.47) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL13687327 0.81 ALDH1A1 (0.48) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL9735108 0.81 EPHX2 (0.44) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL18199506 0.79 MEN1 (0.52) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR
SCHEMBL12107521 0.79 CASP2 (0.53) EPHX2SMN1; SMN2TSHRPCNAHPGD
SCHEMBL459746 0.79 EPHX2 (0.42) EPHX2RAB9AALDH1A1SMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160114052-A1 POTENT CONJUGATES AND HYDROPHILIC LINKERS IMMUNOGEN, INC. (US) 2016-04-28 US disclosed
US-9150649-B2 Potent conjugates and hydrophilic linkers IMMUNOGEN, INC. (US) 2015-10-06 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-20160114052-A1 POTENT CONJUGATES AND HYDROPHILIC LINKERS CD44, EPCAM, ABCG2 EPHX2 859/4885RAB9A 4063/4885ALDH1A1 1029/4885

“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.