SCHEMBL26501684

SCHEMBL26501684

Cc1ccc(CC(=O)Cc2nc(C(C)C)cs2)nn1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 2/20 0.36
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
MAPK1 P28482 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
GRM1 Q13255 1/20 0.34
ALDH1A1 P00352 6/20 0.33
RAB9A P51151 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
GAA P10253 2/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
DRD4 P21917 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
GFER P55789 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL26501801 0.81 POLB (0.33) SLC40A1CYP1A2CYP2D6CYP2C9GRM1
SCHEMBL26501659 0.80 SLC40A1 (0.34) SLC40A1KMT2AMEN1MAPK1ALDH1A1
SCHEMBL26501704 0.78 RAB9A (0.45) KMT2AMEN1MAPK1CYP1A2CYP2D6
SCHEMBL26501720 0.77 MEN1 (0.31) SLC40A1KMT2AMEN1MAPK1RAB9A
SCHEMBL26501683 0.74 ALDH1A1 (0.33) ALDH1A1RAB9AL3MBTL1GAAMAPT
SCHEMBL24536020 0.73 PANK3 (0.35) KMT2AMEN1CYP1A2CYP2D6CYP2C9
SCHEMBL26501678 0.73 PANK3 (0.42) KMT2AMEN1SMN1; SMN2
SCHEMBL5516186 0.73 ALDH1A1 (0.40) KMT2AMEN1CYP1A2CYP2D6CYP2C9
SCHEMBL12190531 0.73 GAA (0.40) KMT2AMEN1MAPK1CYP1A2CYP2D6
SCHEMBL26501518 0.71 CNR2 (0.38) KMT2AMEN1RAB9ASMN1; SMN2

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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 SLC40A1 1313/4885KMT2A 1296/4885MEN1 2263/4885

“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.