SCHEMBL24554348

SCHEMBL24554348

CC(C)(S)NC(=O)c1ccc(F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
PTPN1 P18031 1/20 0.46
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 3/20 0.45
HDAC1 Q13547 2/20 0.45
ATM Q13315 1/20 0.45
MITF O75030 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CYP2D6 P10635 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC2 Q92769 1/20 0.44
MAPT P10636 1/20 0.43
XBP1 P17861 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL6417124 0.84 LMNA (0.50) MEN1KMT2APTPN1CES2CES1
SCHEMBL19625786 0.84 LMNA (0.50) MEN1KMT2APTPN1CES2CES1
SCHEMBL1233194 0.81 MEN1 (0.47) MEN1KMT2APTPN1CES2CES1
SCHEMBL1742088 0.79 EGLN1 (0.50) MEN1KMT2APTPN1CES2CES1
SCHEMBL12206267 0.78 KCNN4 (0.48) MEN1KMT2APTPN1CES2CES1
SCHEMBL13293313 0.78 ALDH1A1 (0.49) MEN1KMT2APTPN1CES2CES1
SCHEMBL3757683 0.78 NPC1 (0.52) MEN1KMT2APTPN1NPC1RAB9A
SCHEMBL25780577 0.78 KDM4E (0.61) MEN1KMT2ARAB9AHDAC1ALDH1A1
SCHEMBL28450707 0.77 DGAT1 (0.51) MEN1KMT2APTPN1CES2CES1
SCHEMBL3835902 0.75 PPARG (0.52) MEN1KMT2ANPC1RAB9AHDAC1

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-20220194930-A1 Matrix Metalloproteinase Inhibitors and Imaging Agents, And Methods Using Same UNIV YALE (US) 2022-06-23 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-20220194930-A1 Matrix Metalloproteinase Inhibitors and Imaging Agents, And Methods Using Same MMP3, MMP1, MMP10 MEN1 450/4885KMT2A 2836/4885PTPN1 4564/4885

“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.