SCHEMBL6640244

SCHEMBL6640244

Cc1cc(C(=O)O)c(-c2ccccc2)cc1N(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
FOLH1 Q04609 1/20 0.43
LDHA P00338 1/20 0.43
PTPN1 P18031 2/20 0.42
LTB4R Q15722 1/20 0.42
LTB4R2 Q9NPC1 1/20 0.42
MCL1 Q07820 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
ACLY P53396 1/20 0.41
HNF4A P41235 1/20 0.41
ALDH1A1 P00352 3/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
AKR1C1 Q04828 1/20 0.41

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
SCHEMBL6500060 0.83 ALDH1A1 (0.51) FOLH1LDHAPTPN1MCL1HDAC7
SCHEMBL6637829 0.83 ACLY (0.46) SMN1; SMN2MEN1KMT2AFOLH1PTPN1
SCHEMBL27967819 0.81 LDHA (0.46) SMN1; SMN2MEN1KMT2AFOLH1LDHA
SCHEMBL6641207 0.79 FABP4 (0.45) SMN1; SMN2MEN1KMT2AFOLH1PTPN1
SCHEMBL27532813 0.78 LDHA (0.53) FOLH1LDHAPTPN1MCL1HDAC7
SCHEMBL6637362 0.77 PRKAB2 (0.48) MEN1KMT2AFOLH1LDHAPTPN1
SCHEMBL667582 0.76 PTPN1 (0.59) FOLH1PTPN1MCL1HDAC7HNF4A
SCHEMBL10697549 0.76 KDM4E (0.50) SMN1; SMN2ALDH1A1TP53GAAMAPT
SCHEMBL9171492 0.74 PTPN1 (0.57) FOLH1PTPN1MCL1HDAC7HNF4A
SCHEMBL28804822 0.74 LDHA (0.57) FOLH1LDHAPTPN1MCL1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383760-A1 BIARYLCARBOXAMIDE COMPOUNDS AS APOLIPOPROTEIN B INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-01-28 EP disclosed
WO-2002090347-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-14 WO disclosed