SCHEMBL15840593

SCHEMBL15840593

CCOc1cccc2c(C)nc(Nc3nc(CSc4ccc(C)cc4)cc(=O)[nH]3)nc12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.77
ALDH1A1 P00352 11/20 0.77
SMN1; SMN2 Q16637 6/20 0.77
KMT2A Q03164 5/20 0.77
CREBBP Q92793 3/20 0.62
PKM P14618 1/20 0.62
KDM4E B2RXH2 1/20 0.61
LMNA P02545 4/20 0.51
PAX8 Q06710 1/20 0.51
HTT P42858 2/20 0.50
CYP1A2 P05177 1/20 0.50
ALPL P05186 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
XBP1 P17861 1/20 0.50
CYP2C19 P33261 1/20 0.50
STAT3 P40763 1/20 0.50
VSIR Q9H7M9 1/20 0.49
MEN1 O00255 1/20 0.49

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
SCHEMBL15840708 0.87 MAPT (1.00) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840835 0.81 MAPT (0.81) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840749 0.78 MAPK1 (0.66) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840766 0.76 MAPT (1.00) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840824 0.76 STAT3 (0.55) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840836 0.75 MAPT (0.71) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840698 0.75 AURKA (0.46) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840757 0.71 KMT2A (0.62) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840779 0.71 MAPT (0.70) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP
SCHEMBL15840589 0.70 AURKA (0.46) MAPTALDH1A1SMN1; SMN2KMT2ACREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT Errico, Joseph P. (US) 2014-06-26 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-20140179681-A1 METHODS AND COMPOSITIONS OF TARGETED DRUG DEVELOPMENT EGFR, ERBB2, ERBB3 MAPT 1076/4885ALDH1A1 4348/4885SMN1; SMN2 3999/4885

“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.