SCHEMBL25987161

SCHEMBL25987161

CS[C@]1(C(=O)O)Cc2ccccc2N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
CREBBP Q92793 2/20 0.33
AHR P35869 1/20 0.33
PDK2 Q15119 1/20 0.33
NPC1 O15118 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
CXCR5 P32302 2/20 0.32
HDAC9 Q9UKV0 1/20 0.32
SIRT5 Q9NXA8 1/20 0.32
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
HSD17B3 P37058 1/20 0.31

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
SCHEMBL5837737 0.75 BRD4 (0.42) BRD4MEN1KMT2AMAPTGAA
SCHEMBL6773172 0.75 BRD4 (0.42) BRD4MEN1KMT2AMAPTGAA
SCHEMBL9752039 0.71 MAPT (0.39) BRD4MEN1KMT2AMAPTGAA
SCHEMBL38660901 0.71 MAPT (0.39) BRD4MEN1KMT2AMAPTGAA
SCHEMBL29192390 0.69 BRD4 (0.38) BRD4MEN1KMT2AMAPTGAA
SCHEMBL1144876 0.68 AHR (0.37) BRD4MEN1KMT2AMAPTGAA
SCHEMBL2255293 0.66 BRD4 (0.40) BRD4MEN1KMT2AMAPTGAA
SCHEMBL9194873 0.66 PDK2 (0.42) BRD4MEN1KMT2AMAPTGAA
SCHEMBL10098236 0.66 MEN1 (0.43) MEN1KMT2AMAPTGAANPC1
SCHEMBL1119036 0.65 GAA (0.46) BRD4MEN1KMT2AMAPTGAA

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-20230242567-A1 CHIRAL PHOSPHORAMIDITE AUXILIARIES AND METHODS OF THEIR USE SIRIUS THERAPEUTICS, INC. 2023-08-03 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-20230242567-A1 CHIRAL PHOSPHORAMIDITE AUXILIARIES AND METHODS OF THEIR USE PNP, PCNA, NUDT14 BRD4 4133/4885MEN1 1440/4885KMT2A 3376/4885

“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.