SCHEMBL2098652

SCHEMBL2098652

CCCCCCCCCC(=O)NN1C(=O)CSC1=S

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.56
ALDH1A1 P00352 5/20 0.56
RECQL P46063 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALPL P05186 1/20 0.56
POLB P06746 1/20 0.56
ALPI P09923 1/20 0.56
ALPG P10696 1/20 0.56
PLCG1 P19174 1/20 0.56
CASP6 P55212 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
GAA P10253 9/20 0.53
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
THRB P10828 1/20 0.49
GNAI3 P08754 1/20 0.46
GNAO1 P09471 1/20 0.46
GNAI1 P63096 1/20 0.46
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL8224178 0.99 MAPT (0.58) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL39550 0.77 MAPT (0.55) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL6324088 0.76 MAPT (0.67) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL9190544 0.75 GNAI3 (0.46) KMT2AGNAI3GNAO1GNAI1HSP90AA1
SCHEMBL9190539 0.75 GNAI3 (0.46) GNAI3GNAO1GNAI1HSP90AA1FAAH
SCHEMBL5489393 0.75 MEN1 (0.48) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL5482614 0.75 MEN1 (0.48) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL5485904 0.75 MEN1 (0.48) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL5487649 0.74 MEN1 (0.46) MAPTALDH1A1RECQLKDM4EALPL
SCHEMBL29271909 0.69 GNAI3 (0.46) MAPTALDH1A1KMT2AMEN1GNAI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163910-B2 Amide-substituted xanthene dyes ELITECH HOLDING B.V. (NL) 2012-04-24 US disclosed
US-20090093612-A1 AMIDE-SUBSTITUTED XANTHENE DYES EPOCH BIOSCIENCES, INC. (US) 2009-04-09 US disclosed
WO-2009046165-A1 AMIDE-SUBSTITUTED XANTHENE DYES EPOCH BIOSCIENCES, INC. (US) 2009-04-09 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-20090093612-A1 AMIDE-SUBSTITUTED XANTHENE DYES ANXA5, PHOSPHO1, TPST2 MAPT 1987/4885ALDH1A1 4277/4885RECQL 2745/4885

“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.