SCHEMBL30678992

SCHEMBL30678992

Cc1cc(C)cc(C(C)C(=O)ONC(=O)OCC(Cl)(Cl)Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
MAPT P10636 1/20 0.32
PSEN1 P49768 1/20 0.30
PSEN2 P49810 1/20 0.30
APH1B Q8WW43 1/20 0.30
NCSTN Q92542 1/20 0.30
APH1A Q96BI3 1/20 0.30
PSENEN Q9NZ42 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL30678961 0.86 KMT2A (0.40) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL30678987 0.82 HTT (0.42) MEN1KMT2AHTT
SCHEMBL30678990 0.82 HTT (0.42) MEN1KMT2AHTT
SCHEMBL30678934 0.82 HTT (0.42) MEN1KMT2AHTT
SCHEMBL30678988 0.81 L3MBTL1 (0.41) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL30678991 0.80 MEN1 (0.38) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL30678960 0.80 CYP1A2 (0.39) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL30678968 0.80 CYP1A2 (0.39) MEN1KMT2ALMNAHTTSMN1; SMN2
SCHEMBL30678935 0.79 GPR88 (0.43) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL30678948 0.79 ATM (0.48) MEN1KMT2ALMNAHTTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4249470-B1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS UNIV MARBURG (DE) 2024-11-13 EP disclosed
EP-4249470-A1 METHOD FOR PREPARING ALPHA-AMINO ACIDS PHILIPPS-UNIVERSITÄT MARBURG (DE) 2023-09-27 EP disclosed