SCHEMBL23922303

SCHEMBL23922303

CC(C)NC(=O)CCc1nccs1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.42
HTT P42858 1/20 0.42
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FDPS P14324 1/20 0.41
HPGD P15428 2/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ACACB O00763 1/20 0.39
FAAH O00519 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL26865302 0.85 HTT (0.45) ALDH1A1KMT2AMEN1HTTGAA
SCHEMBL10153776 0.82 ALDH1A1 (0.42) ALDH1A1KMT2AMEN1SMN1; SMN2FDPS
SCHEMBL6298490 0.79 FDPS (0.44) ALDH1A1KMT2AMEN1FDPSPKM
SCHEMBL6254715 0.77 CTSK (0.41) ALDH1A1POLBSMN1; SMN2FDPSHPGD
SCHEMBL291399 0.77 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1HTTSMN1; SMN2
SCHEMBL4574427 0.76 ALDH1A1 (0.47) ALDH1A1KMT2AMEN1HTTSMN1; SMN2
SCHEMBL28011812 0.76 FDPS (0.46) ALDH1A1KMT2AMEN1FDPSPKM
SCHEMBL992041 0.74 FDPS (0.44) ALDH1A1FDPSHPGDTSHR
SCHEMBL12530273 0.73 ALDH1A1 (0.44) ALDH1A1KMT2AMEN1HTTSMN1; SMN2
SCHEMBL14257698 0.73 FDPS (0.43) ALDH1A1FDPSPKMTSHR

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-11833210-B2 ASH1L inhibitors and methods of treatment therewith THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2023-12-05 US disclosed
US-11147885-B2 ASH1L inhibitors and methods of treatment therewith THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-10-19 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 (2 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-11833210-B2 ASH1L inhibitors and methods of treatment therewith ASH1L, DOT1L, ASH2L ALDH1A1 802/4885KMT2A 23/4885MEN1 3491/4885
US-11147885-B2 ASH1L inhibitors and methods of treatment therewith ASH1L, DOT1L, ASH2L ALDH1A1 802/4885KMT2A 23/4885MEN1 3491/4885

“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.