SCHEMBL29998624

SCHEMBL29998624

NC(=O)Cc1cc(C(=O)O)nc(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.40
LOXL2 Q9Y4K0 2/20 0.39
P2RX7 Q99572 1/20 0.39
MAOB P27338 1/20 0.39
POLB P06746 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 2/20 0.36
HPGD P15428 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C19 P33261 1/20 0.35
PDE4B Q07343 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34

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
SCHEMBL26918593 1.00 PDE4D (0.40) PDE4DLOXL2P2RX7MAOBPOLB
SCHEMBL29998784 0.82 ALDH1A1 (0.40) PDE4DLOXL2P2RX7MAOBALDH1A1
SCHEMBL26918824 0.82 ALDH1A1 (0.40) PDE4DLOXL2P2RX7MAOBALDH1A1
SCHEMBL2393767 0.77 FABP4 (0.39) LOXL2P2RX7POLBALDH1A1HSD17B10
SCHEMBL6121928 0.77 HCAR2 (0.43) LOXL2POLBALDH1A1HSD17B10L3MBTL1
SCHEMBL6122462 0.76 ALDH1A1 (0.38) PDE4DLOXL2P2RX7POLBALDH1A1
SCHEMBL27077029 0.75 ALOX15 (0.41) LOXL2P2RX7POLBALDH1A1HSD17B10
SCHEMBL30697188 0.75 ALOX15 (0.41) LOXL2P2RX7POLBALDH1A1HSD17B10
SCHEMBL12097960 0.73 CES2 (0.45) P2RX7ALDH1A1HSD17B10HPGDALOX15
SCHEMBL26919067 0.72 CYP3A4 (0.40) PDE4DP2RX7POLBALDH1A1HSD17B10

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-4288428-A1 AMIDES AS CBL-B INHIBITORS Genentech, Inc. (US) 2023-12-13 EP disclosed
WO-2022169998-A1 AMIDES AS CBL-B INHIBITORS GENENTECH, INC. (US) 2022-08-11 WO disclosed