SCHEMBL23401355

SCHEMBL23401355

CCc1c(O)nn(-c2cccc(C)c2)c1-c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
RPA1 P27694 1/20 0.40
MAPT P10636 5/20 0.39
LMNA P02545 4/20 0.39
KMT2A Q03164 3/20 0.39
TP53 P04637 2/20 0.39
KDM4E B2RXH2 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
ESR1 P03372 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
NFKB1 P19838 1/20 0.39

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
SCHEMBL23402150 0.92 RPA1 (0.48) ALDH1A1L3MBTL1RPA1MAPTKMT2A
SCHEMBL23401010 0.91 ALDH1A1 (0.47) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23398778 0.90 LMNA (0.48) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23401244 0.89 LMNA (0.41) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23399622 0.88 CYP2C9 (0.44) ALDH1A1MAPTLMNAKMT2ATP53
SCHEMBL23399236 0.87 L3MBTL1 (0.48) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23402474 0.86 ALDH1A1 (0.38) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23401053 0.86 MAPT (0.50) ALDH1A1L3MBTL1MAPTLMNAKMT2A
SCHEMBL23401755 0.84 ALDH1A1 (0.48) ALDH1A1L3MBTL1RPA1MAPTLMNA
SCHEMBL23402660 0.83 ALDH1A1 (0.44) ALDH1A1L3MBTL1RPA1MAPTLMNA

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