SCHEMBL24877935

SCHEMBL24877935

CCOC(=O)c1c2c(nn1CC(=O)OCC(C)C)C(=O)CCC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM2 O94759 1/20 0.38
BRD4 O60885 1/20 0.38
LMNA P02545 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ALDH1A1 P00352 5/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 2/20 0.35
POLB P06746 1/20 0.34
ESR2 Q92731 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL21996008 0.83 TRPM2 (0.39) TRPM2BRD4LMNAMEN1KMT2A
SCHEMBL24877933 0.80 BRD4 (0.38) TRPM2BRD4LMNAMEN1KMT2A
SCHEMBL4166091 0.77 BRD4 (0.41) TRPM2BRD4LMNAMEN1KMT2A
SCHEMBL12499870 0.77 HTT (0.41) TRPM2BRD4LMNAMEN1KMT2A
SCHEMBL23850047 0.75 LMNA (0.46) BRD4LMNAMEN1KMT2ANPSR1
SCHEMBL12499362 0.74 BRD4 (0.43) BRD4LMNAMEN1KMT2ANPSR1
SCHEMBL23849972 0.73 SMN1; SMN2 (0.41) TRPM2BRD4LMNAMEN1KMT2A
SCHEMBL23850212 0.73 CYP19A1 (0.42) BRD4LMNAKMT2ANPSR1ALDH1A1
SCHEMBL9937024 0.72 UCHL1 (0.48) MEN1KMT2ANPSR1ALDH1A1SMN1; SMN2
SCHEMBL4159155 0.70 LMNA (0.42) TRPM2BRD4LMNAMEN1KMT2A

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-20230008022-A1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS MERCK SHARP & DOHME CORP. (US) 2023-01-12 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-20230008022-A1 NOVEL SUBSTITUTED PIPERAZINE AMIDE COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE (IDO) INHIBITORS IDO1, IDO2, KYNU TRPM2 3029/4885BRD4 696/4885LMNA 4773/4885

“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.