SCHEMBL27421833

SCHEMBL27421833

Cc1cc(S(=O)(=O)Nc2ccc3ccn(C(C)C)c3c2)c(C)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ HSD17B1 P14061 1/20 0.52
▸ HSD17B2 P37059 1/20 0.52
▸ LMNA P02545 4/20 0.45
▸ S1PR1 P21453 2/20 0.44
▸ CDK1 P06493 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ CDK7 P50613 1/20 0.43
▸ CCNH P51946 1/20 0.43
▸ CCNA1 P78396 1/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ MAPT P10636 4/20 0.43
▸ THRB P10828 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ TP53 P04637 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ GAA P10253 1/20 0.41

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
SCHEMBL27422020 0.86 MEN1 (0.57) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL3061861 0.81 MEN1 (0.48) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL3058830 0.79 HSD17B1 (0.50) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL3047557 0.78 KMO (0.52) MEN1KMT2AHSD17B1HSD17B2S1PR1
SCHEMBL13139532 0.76 MEN1 (0.47) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL13139523 0.75 MEN1 (0.46) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL27422029 0.71 MEN1 (0.56) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL14433794 0.70 THRB (0.70) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL27423760 0.70 MEN1 (0.61) MEN1KMT2AHSD17B1HSD17B2LMNA
SCHEMBL14433960 0.69 HSD17B1 (0.56) MEN1KMT2AHSD17B1HSD17B2LMNA

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
WO-2024137813-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2024-06-27 — — WO disclosed
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