SCHEMBL23398395

SCHEMBL23398395

CCCc1c(C)c(O)nn1-c1ccc(C)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.38
KMT2A Q03164 4/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 3/20 0.38
CYP2C9 P11712 3/20 0.38
MAPK1 P28482 2/20 0.38
USP2 O75604 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
ESR1 P03372 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GMNN O75496 1/20 0.38
CYP2D6 P10635 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
ALOX12 P18054 1/20 0.38
NFKB1 P19838 1/20 0.38
THPO P40225 1/20 0.38

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
SCHEMBL23401675 0.91 RAB9A (0.36) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23402826 0.89 TP53 (0.43) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23400171 0.88 TP53 (0.40) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23398392 0.87 USP2 (0.49) KMT2ALMNAMAPTMAPK1USP2
SCHEMBL23401766 0.87 ALDH1A1 (0.38) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23401674 0.86 MAPK1 (0.39) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23403617 0.85 PDE4D (0.44) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23401194 0.83 MAPT (0.42) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23403174 0.82 MAPK1 (0.41) TP53KMT2ALMNAMAPTCYP2C9
SCHEMBL23399917 0.81 TP53 (0.43) TP53KMT2ALMNAMAPTCYP2C9

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