SCHEMBL23399667

SCHEMBL23399667

Cc1ccc(-c2c(O)nn(C(C)(C)C)c2C(C)C)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
PLK4 O00444 1/20 0.35
RIPK2 O43353 1/20 0.35
ROCK2 O75116 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
ABL1 P00519 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
INSR P06213 1/20 0.35
LCK P06239 1/20 0.35
FYN P06241 1/20 0.35
CSF1R P07333 1/20 0.35
YES1 P07947 1/20 0.35
LYN P07948 1/20 0.35
RET P07949 1/20 0.35

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
SCHEMBL23402724 0.86 SMN1; SMN2 (0.45) HPGDALDH1A1LMNAKDM4EABL1
SCHEMBL23402604 0.81 ALDH1A1 (0.38) HPGDALDH1A1HTTLMNAKDM4E
SCHEMBL23402221 0.80 HPGD (0.38) HPGDALDH1A1HTTLMNAKDM4E
SCHEMBL23402959 0.80 GCGR (0.37) HPGDALDH1A1USP7MEN1KMT2A
SCHEMBL23400136 0.79 RIPK2 (0.44) HPGDALDH1A1HTTLMNAKDM4E
SCHEMBL23398613 0.78 DPP4 (0.36) HPGDALDH1A1HTTLMNAKDM4E
SCHEMBL23401950 0.78 HPGD (0.37) HPGDALDH1A1HTTLMNAKDM4E
SCHEMBL23400454 0.78 HTR2B (0.37) ALDH1A1LMNAKDM4EABL1EGFR
SCHEMBL23403462 0.77 SMN1; SMN2 (0.40) HPGDALDH1A1HTTLMNASRC
SCHEMBL23401223 0.76 GCGR (0.37) HPGDALDH1A1HTTLMNAKDM4E

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