SCHEMBL23399378

SCHEMBL23399378

Cc1ccc(-c2cn(-c3ccc(C)cc3)nc2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
CNR1 P21554 5/20 0.45
GPR35 Q9HC97 1/20 0.45
NOTUM Q6P988 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 1/20 0.43
PTGS2 P35354 3/20 0.43
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
GPR55 Q9Y2T6 2/20 0.40
CNR2 P34972 1/20 0.40
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
CASP3 P42574 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
SCHEMBL23400281 0.92 KMT2A (0.58) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23399931 0.92 RAB9A (0.51) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23400607 0.89 RAB9A (0.56) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL12789095 0.84 PTGS2 (0.40) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23399832 0.84 MEN1 (0.45) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23400188 0.84 HPGD (0.46) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL11825390 0.82 KDM4E (0.44) RAB9ANPC1KMT2ACNR1NOTUM
SCHEMBL23400779 0.81 NPC1 (0.41) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23399106 0.81 NPC1 (0.47) RAB9ANPC1MEN1KMT2ACNR1
SCHEMBL23399682 0.79 MEN1 (0.41) RAB9ANPC1MEN1KMT2ASMN1; SMN2

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