SCHEMBL23403292

SCHEMBL23403292

CCCn1nc(-c2ccccc2C)c(-c2ccccc2)c1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.48
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 2/20 0.42
CRHBP P24387 1/20 0.42
MAPK1 P28482 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
CRHR2 Q13324 1/20 0.42
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
STAT6 P42226 1/20 0.36
HIF1A Q16665 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NR1H3 Q13133 1/20 0.36
DPP4 P27487 1/20 0.36

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
SCHEMBL23399777 0.92 NR1H3 (0.46) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23402023 0.92 ESR1 (0.46) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23403273 0.89 SMN1; SMN2 (0.41) ESR1MEN1MAPTKMT2ACRHBP
SCHEMBL23402700 0.86 MEN1 (0.51) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23403633 0.83 ESR1 (0.46) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23401193 0.83 ALDH1A1 (0.36) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23401922 0.82 ESR1 (0.49) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23400518 0.82 ESR1 (0.49) ESR1MEN1MAPTKMT2ATSHR
SCHEMBL23398501 0.81 MAPT (0.41) MEN1MAPTKMT2ATSHRMAPK1
SCHEMBL23403352 0.81 ESR1 (0.44) ESR1MEN1MAPTKMT2ATSHR

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed