SCHEMBL19554335

SCHEMBL19554335

N#Cc1ccc(NC(=O)c2ccc3cc(F)ccc3c2)c(C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALB P02768 2/20 0.51
KCNK2 O95069 1/20 0.50
DHODH Q02127 1/20 0.47
PLAU P00749 2/20 0.46
F2 P00734 1/20 0.46
PLG P00747 1/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
MAP2K1 Q02750 1/20 0.45
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
MAPT P10636 3/20 0.43
RAB9A P51151 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 1/20 0.42
GFER P55789 1/20 0.42
CA12 O43570 2/20 0.42

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
SCHEMBL6348543 0.89 ALB (0.58) ALBKCNK2MAP2K1MEN1KMT2A
SCHEMBL6352338 0.88 KMT2A (0.57) ALBDHODHPLAUF2PLG
SCHEMBL19554161 0.86 CA2 (0.56) ALBKCNK2MEN1KMT2ACA12
SCHEMBL19554146 0.86 DHODH (0.66) ALBKCNK2DHODHPLAUF2
SCHEMBL6359497 0.85 KMT2A (0.53) ALBMEN1KMT2AMAPTTDP1
SCHEMBL6359401 0.83 ALB (0.63) ALBPLAUF2PLGKLKB1
SCHEMBL19554348 0.83 ALB (0.48) ALBDHODHPLAUF2PLG
SCHEMBL19554262 0.82 KCNK2 (0.44) KCNK2DHODHMEN1KMT2AMAPT
SCHEMBL19554177 0.82 KCNK2 (0.44) KCNK2DHODHMEN1KMT2AMAPT
SCHEMBL6349724 0.82 MEN1 (0.51) MEN1KMT2ARAB9ANPC1GFER

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO claimed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed
WO-2017192304-A1 ARYLCARBOXAMIDES AND USES THEREOF INCEPTION 1, INC. (US) 2017-11-09 WO disclosed