SCHEMBL23403174

SCHEMBL23403174

CCCCc1c(CCC)c(O)nn1-c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 2/20 0.41
NFKB1 P19838 2/20 0.41
USP2 O75604 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2D6 P10635 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
LMNA P02545 2/20 0.41
ESR1 P03372 2/20 0.41
GMNN O75496 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ALOX12 P18054 1/20 0.41
CYP2C19 P33261 1/20 0.41
THPO P40225 1/20 0.41

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
SCHEMBL23398747 0.97 KMT2A (0.37) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23401674 0.96 MAPK1 (0.39) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23402826 0.93 TP53 (0.43) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23403014 0.91 KMT2A (0.36) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23402663 0.90 TP53 (0.36) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23401675 0.88 RAB9A (0.36) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23399917 0.88 TP53 (0.43) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23399865 0.87 USP2 (0.43) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23403450 0.87 TP53 (0.35) MAPK1TP53MAPTKMT2ANFKB1
SCHEMBL23403013 0.85 USP2 (0.44) MAPTKMT2AUSP2LMNATSHR

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