SCHEMBL27419973

SCHEMBL27419973

CCCCCCCCCCCCOCCC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 4/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ THRB P10828 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ NAAA Q02083 1/20 0.44
▸ DGKA P23743 1/20 0.44
▸ FAAH O00519 7/20 0.40
▸ CES1 P23141 6/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ PLA2G4B P0C869 1/20 0.39

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
SCHEMBL4005309 1.00 CES2 (0.47) CES2MEN1KMT2ATHRBHTT
SCHEMBL21539334 0.98 MEN1 (0.48) CES2MEN1KMT2ATHRBHTT
SCHEMBL21759092 0.98 MEN1 (0.48) CES2MEN1KMT2ATHRBHTT
SCHEMBL21539433 0.98 MEN1 (0.48) CES2MEN1KMT2ATHRBHTT
SCHEMBL23469978 0.98 CES2 (0.44) CES2MEN1KMT2ATHRBHTT
SCHEMBL21539314 0.96 MEN1 (0.46) CES2MEN1KMT2ATHRBHTT
SCHEMBL20365468 0.93 DGKA (0.53) CES2MEN1KMT2ATHRBHTT
SCHEMBL27775989 0.93 TSHR (0.43) CES2MEN1KMT2ATHRBHTT
SCHEMBL18520324 0.91 TSHR (0.42) CES2MEN1KMT2ATHRBHTT
SCHEMBL25148521 0.91 TSHR (0.42) CES2MEN1KMT2ATHRBHTT

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-2024112119-A1 DEGRADER FOR DECOMPOSING CMET PROTEIN, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 이노큐어테라퓨틱스 2024-05-30 — — WO disclosed
Send feedback