SCHEMBL11640477

SCHEMBL11640477

O=C(O)Cc1ccc2nc(Nc3ccc(Cl)cc3)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.49
IL6 P05231 1/20 0.45
STAT3 P40763 1/20 0.45
HPSE Q9Y251 3/20 0.44
MAPT P10636 1/20 0.44
KCNH2 Q12809 2/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RAF1 P04049 1/20 0.43
BRAF P15056 1/20 0.43
KDR P35968 1/20 0.43
LMNA P02545 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4D Q08499 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL11636238 0.90 HPSE (0.55) CSNK1DIL6STAT3HPSEKCNH2
SCHEMBL2437918 0.89 NPC1 (0.56) CSNK1DIL6STAT3HPSEGAA
SCHEMBL6614738 0.88 HDAC6 (0.53) CSNK1DIL6STAT3HPSEMAPT
SCHEMBL11637058 0.85 PSEN1 (0.46) CSNK1DIL6STAT3HPSEMAPT
SCHEMBL2436176 0.81 NPC1 (0.59) CSNK1DHPSERAF1BRAFNPC1
SCHEMBL7659834 0.80 KDM4E (0.52) IL6STAT3HPSEMAPTGAA
SCHEMBL7429665 0.80 NPC1 (0.53) IL6STAT3HPSEMAPTGAA
SCHEMBL2429205 0.80 NPC1 (0.66) CSNK1DIL6STAT3MAPTGAA
SCHEMBL14371695 0.79 GAA (0.50) CSNK1DHPSEMAPTGAAMEN1
SCHEMBL11640133 0.79 CSNK1D (0.48) CSNK1DIL6STAT3GAAPDE4B

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
US-4100168-A ANALGESICS, ANTIPYRETIC, ANTIINFLAMMATORY AGENTS LILLY INDUSTRIES LTD. (GB) 1978-07-11 US disclosed