SCHEMBL5584029

SCHEMBL5584029

COC(=O)c1ccc(Sc2nc3ccc(NC(=O)NCCN4CCOCC4)cc3s2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.51
PRMT3 O60678 1/20 0.50
MET P08581 8/20 0.49
CYP3A4 P08684 6/20 0.49
TP53 P04637 2/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HDAC1 Q13547 1/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
KMT2A Q03164 1/20 0.47
THRB P10828 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL210846 0.89 HDAC1 (0.61) ABL1PRMT3CYP3A4TP53RXFP1
SCHEMBL1064126 0.79 HDAC1 (0.71) CYP3A4TP53RXFP1HDAC1POLB
SCHEMBL211323 0.74 HDAC1 (0.85) CYP3A4TP53RXFP1HDAC1MAPT
SCHEMBL5476417 0.70 PRMT3 (0.56) PRMT3TP53MAPTSMN1; SMN2MEN1
SCHEMBL612904 0.70 MET (0.64) ABL1METCYP3A4POLBMAPT
SCHEMBL613934 0.70 ABL1 (0.69) ABL1METCYP3A4POLBMAPT
SCHEMBL543789 0.70 ABL1 (0.69) ABL1METCYP3A4POLBMAPT
SCHEMBL30416740 0.69 LMNA (0.73) MAPTSMN1; SMN2LMNA
SCHEMBL5741437 0.69 MAPK1 (0.59) POLBMAPTSMN1; SMN2MEN1NPC1
SCHEMBL2802346 0.69 MET (0.87) ABL1METCYP3A4

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-7253204-B2 Antiproliferative agents METHYLGENE INC. (CA) 2007-08-07 US disclosed
US-20050245518-A1 Antiproliferative agents METHYLGENE, INC. 2005-11-03 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-20050245518-A1 Antiproliferative agents HDAC1, HDAC11, HDAC5 ABL1 1122/4885PRMT3 659/4885MET 1970/4885

“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.