SCHEMBL23399557

SCHEMBL23399557

Cc1cccc(-c2cn(-c3ccccc3C)nc2O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.41
USP2 O75604 2/20 0.40
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ALDH1A1 P00352 3/20 0.38
CNR1 P21554 2/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
KMT2A Q03164 1/20 0.37
ADORA3 P0DMS8 2/20 0.36
RPA1 P27694 1/20 0.36
RPS6KA3 P51812 1/20 0.36
ADORA2A P29274 1/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 2/20 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
SCHEMBL11825632 0.87 ADORA3 (0.43) TSHRLMNAPOLBNPSR1ALDH1A1
SCHEMBL23400298 0.84 MEN1 (0.40) MAPTLMNAPOLBALDH1A1NPC1
SCHEMBL23402722 0.83 ALDH1A1 (0.48) CNR2MAPTTSHRLMNAALDH1A1
SCHEMBL11827724 0.82 KDM4E (0.40) MAPTLMNAPOLBHTTALDH1A1
SCHEMBL23401652 0.81 ALDH1A1 (0.44) CNR2MAPTLMNAPOLBALDH1A1
SCHEMBL23400999 0.81 CNR2 (0.39) CNR2USP2MAPTTSHRLMNA
SCHEMBL23403679 0.81 ADORA3 (0.41) USP2MAPTTSHRLMNANPSR1
SCHEMBL23400188 0.80 HPGD (0.46) CNR2MAPTLMNAPOLBHTT
SCHEMBL23398666 0.77 JMJD6 (0.47) CNR2ALDH1A1CNR1NPC1RAB9A
SCHEMBL23400984 0.77 ADORA3 (0.46) MAPTLMNAPOLBALDH1A1NPC1

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