SCHEMBL6739345

SCHEMBL6739345

CN(C)c1ccc(C=CC=C2SC(=S)N(c3ccc(C(=O)O)cc3)C2=O)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.78
MEN1 O00255 4/20 0.78
KMT2A Q03164 4/20 0.78
ALDH1A1 P00352 3/20 0.78
POLB P06746 3/20 0.78
RECQL P46063 3/20 0.78
NPC1 O15118 3/20 0.78
TDP1 Q9NUW8 3/20 0.78
ALPG P10696 2/20 0.78
L3MBTL1 Q9Y468 2/20 0.78
HTT P42858 2/20 0.78
THRB P10828 2/20 0.78
RAB9A P51151 2/20 0.78
SMN1; SMN2 Q16637 2/20 0.78
LMNA P02545 1/20 0.78
PTPN1 P18031 1/20 0.78
PSMD14 O00487 1/20 0.78
PKM P14618 1/20 0.78
NPSR1 Q6W5P4 1/20 0.78
DUSP22 Q9NRW4 2/20 0.57

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
SCHEMBL6738029 0.88 MAPT (1.00) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL12589911 0.77 APP (0.61) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL14213563 0.76 MAPT (0.79) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL13170370 0.76 DUSP22 (0.70) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL14213564 0.76 MAPT (0.78) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL12637129 0.75 DUSP22 (0.80) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL14065931 0.75 MAPT (0.66) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10491520 0.75 KMT2A (0.76) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL10491519 0.75 KMT2A (0.76) MAPTMEN1KMT2AALDH1A1POLB
SCHEMBL11936880 0.74 MEN1 (0.72) MAPTMEN1KMT2AALDH1A1RECQL

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-20040002526-A1 Phospholipase D inhibitors and uses thereof CELL THERAPEUTICS, INC. 2004-01-01 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-20040002526-A1 Phospholipase D inhibitors and uses thereof PLD2, PLD1, PLA2G2D MAPT 4292/4885MEN1 3009/4885KMT2A 3403/4885

“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.