SCHEMBL1463243

SCHEMBL1463243

CCOc1ccc(NC(=O)C[C@@H]2Sc3ccccc3NC2=O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.72
TP53 P04637 2/20 0.66
KDM4E B2RXH2 1/20 0.66
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
POLB P06746 2/20 0.62
HSD17B10 Q99714 2/20 0.60
TSHR P16473 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
HTT P42858 1/20 0.60
ALDH1A1 P00352 2/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
MAPK1 P28482 1/20 0.58
CYP2C19 P33261 1/20 0.58
HIF1A Q16665 1/20 0.58
GAA P10253 2/20 0.57
MAP2K1 Q02750 1/20 0.57
ADAM17 P78536 1/20 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
SCHEMBL1463247 1.00 MAPT (0.72) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL4141086 0.79 MEN1 (0.83) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL4141088 0.79 MEN1 (0.83) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL4337758 0.77 HSD17B10 (0.74) MAPTTP53MEN1KMT2APOLB
SCHEMBL4321662 0.76 HSD17B10 (0.72) MAPTTP53MEN1KMT2APOLB
SCHEMBL4153284 0.76 MEN1 (0.85) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL4153279 0.76 MEN1 (0.85) MAPTKDM4EMEN1KMT2APOLB
SCHEMBL13273144 0.76 MAPT (0.75) MAPTTP53MEN1KMT2APOLB
SCHEMBL4335577 0.76 HSD17B10 (1.00) MAPTTP53KDM4EMEN1KMT2A
SCHEMBL13873953 0.75 HSD17B10 (1.00) MAPTTP53MEN1KMT2APOLB

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-20110071142-A1 IDENTIFICATION AND USE OF SMALL MOLECULES TO MODULATE TRANSCRIPTION FACTOR FUNCTION AND TO TREAT TRANSCRIPTION FACTOR ASSOCIATED DISEASES BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2011-03-24 US disclosed
US-20110071142-A1 IDENTIFICATION AND USE OF SMALL MOLECULES TO MODULATE TRANSCRIPTION FACTOR FUNCTION AND TO TREAT TRANSCRIPTION FACTOR ASSOCIATED DISEASES BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2011-03-24 US disclosed
WO-2011014299-A2 IDENTIFICATION AND USE OF SMALL MOLECULES TO MODULATE TRANSCRIPTION FACTOR FUNCTION AND TO TREAT TRANSCRIPTION FACTOR ASSOCIATED DISEASES BETH ISRAEL DEACONESS MEDICAL CENTER (US) 2011-02-03 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-20110071142-A1 IDENTIFICATION AND USE OF SMALL MOLECULES TO MODULATE TRANSCRIPTION FACTOR FUNCTION AND TO TREAT TRANSCRIPTION FACTOR ASSOCIATED DISEASES CREBBP, TEAD1, SREBF1 MAPT 3850/4885TP53 518/4885KDM4E 1546/4885

“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.