SCHEMBL27308751

SCHEMBL27308751

COC(C)(C)N(CC1CCCO1)C(=O)OC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
OXTR P30559 3/20 0.35
AVPR1A P37288 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL226527 0.80 HTR2C (0.40) MEN1KMT2AGAALMNAPOLB
SCHEMBL3662388 0.80 HTR2C (0.40) MEN1KMT2AGAALMNAPOLB
SCHEMBL226255 0.80 HTR2C (0.40) MEN1KMT2AGAALMNAPOLB
SCHEMBL4915463 0.79 KMT2A (0.41) MEN1KMT2AGAALMNAPOLB
SCHEMBL7494216 0.79 ALDH1A1 (0.40) KMT2AGAALMNAPOLBOXTR
SCHEMBL4915454 0.79 KMT2A (0.41) MEN1KMT2AGAALMNAPOLB
SCHEMBL12184848 0.77 LMNA (0.41) MEN1KMT2ALMNAPOLBOXTR
SCHEMBL283816 0.75 LMNA (0.38) MEN1KMT2AGAALMNAPOLB
SCHEMBL283815 0.75 LMNA (0.38) MEN1KMT2AGAALMNAPOLB
SCHEMBL10080310 0.72 HTR2C (0.35) MEN1KMT2ALMNAPOLBOXTR

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-2024015262-A1 FUSED RING KRAS INHIBITORS FOR TREATING DISEASE BLOSSOMHILL THERAPEUTICS, INC. (US) 2024-01-18 WO disclosed