SCHEMBL10104241

SCHEMBL10104241

CSCC(=O)NCCCNC(=O)CSC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CASP2 P42575 1/20 0.40
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
HIF1A Q16665 1/20 0.39
NAAA Q02083 1/20 0.38
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PKM P14618 1/20 0.36
FAAH O00519 1/20 0.35
MAPT P10636 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL18649603 0.91 KDM4E (0.54) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL18649601 0.91 KMT2A (0.41) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL19069757 0.89 CASP2 (0.50) KMT2AMEN1CASP2NAAAFAAH
SCHEMBL22014139 0.86 MEN1 (0.38) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL22931711 0.85 MEN1 (0.45) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL12360826 0.85 CASP2 (0.62) KMT2AMEN1CASP2NAAAFAAH
SCHEMBL24330217 0.83 GAA (0.39) KMT2AMEN1ALDH1A1SMN1; SMN2PKM
SCHEMBL21472789 0.83 KMT2A (0.39) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL20829941 0.83 PAOX (0.57) KMT2AMEN1ALDH1A1SMN1; SMN2CASP2
SCHEMBL17010827 0.83 PAOX (0.47) KMT2AMEN1SMN1; SMN2CASP2TSHR

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-20120164039-A1 PALLADIUM ION ADSORBENT AND METHODS FOR SEPARATING AND RECOVERING PALLADIUM USING IT TOSOH CORPORATION (JP) 2012-06-28 US disclosed
WO-2011021696-A1 PALLADIUM ION ADSORBENT AND METHOD FOR SEPARATING AND RECOVERING PALLADIUM USING SAME 東ソー株式会社 (JP) 2011-02-24 WO 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-20120164039-A1 PALLADIUM ION ADSORBENT AND METHODS FOR SEPARATING AND RECOVERING PALLADIUM USING IT PDCD10, PARK7, CCR10 KMT2A 643/4885MEN1 1969/4885ALDH1A1 601/4885

“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.