SCHEMBL30077693

SCHEMBL30077693

CC1(C)OB(c2cc(O)cc3ccc(Cl)cc23)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPL P06858 1/20 0.33
LIPG Q9Y5X9 1/20 0.33
EGFR P00533 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
GFER P55789 1/20 0.33
KMT2A Q03164 1/20 0.33
LIPE Q05469 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL23668643 1.00 LPL (0.33) LPLLIPGEGFRMEN1ALDH1A1
SCHEMBL23569463 0.84 LPL (0.34) LPLLIPGALDH1A1
SCHEMBL25173250 0.82 LPL (0.41) LPLLIPG
SCHEMBL30077847 0.82 LPL (0.41) LPLLIPG
SCHEMBL21459066 0.80 NQO2 (0.46) LPLLIPGMEN1ALDH1A1MAPT
SCHEMBL29414003 0.80 NQO2 (0.46) LPLLIPGMEN1ALDH1A1MAPT
SCHEMBL29964335 0.78 NQO2 (0.41) LPLLIPGMEN1ALDH1A1MAPT
SCHEMBL24176057 0.77 ESR1 (0.34) LPLLIPGEGFR
SCHEMBL31270011 0.77 ESR1 (0.34) LPLLIPGEGFR
SCHEMBL24373694 0.75 MAOA (0.34) LPLLIPG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4415824-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2024-08-21 EP disclosed
WO-2023064857-A1 QUINOLINE COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORPORATION (US) 2023-04-20 WO disclosed
EP-4087843-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2022-11-16 EP disclosed