SCHEMBL19996785

SCHEMBL19996785

Cc1cc(-c2ccc3c(-c4ccccc4)cccc3n2)cc(C)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 2/20 0.44
AR P10275 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
PDGFRB P09619 1/20 0.41
KDR P35968 1/20 0.41
FLT3 P36888 1/20 0.41
RAB9A P51151 1/20 0.41
DHODH Q02127 2/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
ADORA2A P29274 2/20 0.40
PTGER4 P35408 1/20 0.40
TDO2 P48775 1/20 0.40
PDE10A Q9Y233 1/20 0.40
MBNL1 Q9NR56 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 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
SCHEMBL19996780 0.87 ACACA (0.57) ACACASMN1; SMN2NPC1PDGFRBKDR
SCHEMBL17453340 0.84 ACACA (0.46) ACACASMN1; SMN2NPC1RAB9ALMNA
SCHEMBL3458564 0.81 ALDH1A1 (0.48) ACACASMN1; SMN2NPC1RAB9ALMNA
SCHEMBL5149116 0.79 ALDH1A1 (0.47) ACACASMN1; SMN2NPC1RAB9ALMNA
SCHEMBL27552816 0.79 TDP1 (0.50) ACACANPC1RAB9ALMNAHPGD
SCHEMBL13806797 0.79 ACACA (0.47) ACACASMN1; SMN2RAB9ADHODHLMNA
SCHEMBL19996754 0.77 IGF1R (0.44) SMN1; SMN2NPC1PDGFRBKDRFLT3
SCHEMBL19996764 0.75 BACE1 (0.50) ARSMN1; SMN2NPC1PDGFRBKDR
SCHEMBL20809312 0.75 SMN1; SMN2 (0.55) ARSMN1; SMN2NPC1PDGFRBKDR
SCHEMBL27552828 0.75 ACACA (0.49) ACACAARSMN1; SMN2NPC1RAB9A

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-9929357-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-03-27 US disclosed