SCHEMBL25620144

SCHEMBL25620144

Cc1cc(O)cc(C)c1NC(=O)CN1CCCCC1

nearest known ligand 0.81

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.81
KMT2A Q03164 3/20 0.81
POLB P06746 2/20 0.81
RAB9A P51151 3/20 0.61
ALOX15 P16050 1/20 0.61
TP53 P04637 1/20 0.59
NPC1 O15118 4/20 0.58
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
RAD52 P43351 1/20 0.53
HPGD P15428 1/20 0.52

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
SCHEMBL24849177 0.85 MEN1 (0.59) MEN1KMT2APOLBALOX15ALDH1A1
SCHEMBL2096761 0.83 MEN1 (0.73) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL22407740 0.83 MEN1 (0.73) MEN1KMT2APOLBRAB9ANPC1
Pincainide SCHEMBL2110148 0.83 MEN1 (0.73) MEN1KMT2APOLBRAB9ANPC1
Pyrrocaine SCHEMBL25718 0.81 MEN1 (0.70) MEN1KMT2APOLBRAB9AALOX15
Pyrrocaine SCHEMBL10757216 0.80 MEN1 (0.68) MEN1KMT2APOLBRAB9AALOX15
SCHEMBL24849204 0.79 MEN1 (0.52) MEN1KMT2APOLBRAB9AALOX15
Pyrrocaine SCHEMBL1651381 0.79 MEN1 (0.67) MEN1KMT2APOLBRAB9AALOX15
SCHEMBL24849222 0.77 POLB (0.51) MEN1KMT2APOLBALOX15ALDH1A1
SCHEMBL24177661 0.77 HTT (0.60) MEN1KMT2APOLBRAB9AALOX15

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-20230183169-A1 AROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF IN DRUG Sichuan Academy Of Medical Sciences · Sichuan Provincial People's Hospital (CN) 2023-06-15 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-20230183169-A1 AROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF IN DRUG NOTUM, BYSL, TYR MEN1 2637/4885KMT2A 2785/4885POLB 2914/4885

“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.