SCHEMBL31497724

SCHEMBL31497724

O=C(Nc1ccccc1-c1ccccc1)c1cccc(O)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.57
TSHR P16473 4/20 0.57
ALOX15 P16050 1/20 0.57
L3MBTL1 Q9Y468 2/20 0.56
KDM4E B2RXH2 3/20 0.52
ATM Q13315 1/20 0.52
POLB P06746 2/20 0.52
HSD17B10 Q99714 2/20 0.52
MAPT P10636 2/20 0.52
HTT P42858 2/20 0.52
USP2 O75604 1/20 0.52
CHRNB2 P17787 1/20 0.49
CHRNB4 P30926 1/20 0.49
CHRNA3 P32297 1/20 0.49
CHRNA4 P43681 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
RET P07949 1/20 0.47
FLT1 P17948 1/20 0.47

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
SCHEMBL38658375 0.83 ALDH1A1 (0.54) ALDH1A1TSHRALOX15L3MBTL1KDM4E
SCHEMBL19476100 0.80 TSHR (0.74) ALDH1A1TSHRALOX15L3MBTL1KDM4E
SCHEMBL31497712 0.79 NPC1 (0.56) ALDH1A1KDM4EPOLBHSD17B10MAPT
SCHEMBL31497725 0.79 NPC1 (0.59) ALDH1A1TSHRL3MBTL1KDM4EPOLB
SCHEMBL28321638 0.78 POLB (0.79) ALDH1A1L3MBTL1KDM4EPOLBMAPT
SCHEMBL31497718 0.78 POLB (0.79) ALDH1A1L3MBTL1KDM4EPOLBMAPT
SCHEMBL31497722 0.75 HTT (0.56) ALDH1A1TSHRKDM4EMAPTHTT
SCHEMBL20541724 0.74 SIRT1 (0.66) ALDH1A1TSHRALOX15L3MBTL1KDM4E
SCHEMBL12470503 0.74 ALDH1A1 (0.66) ALDH1A1TSHRL3MBTL1KDM4EATM
SCHEMBL29434803 0.74 ALDH1A1 (0.66) ALDH1A1TSHRL3MBTL1KDM4EATM

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
WO-2025095097-A1 Process for producing benzimidazole compound RAQUALIA PHARMA INC. (JP) 2025-05-08 WO claimed
WO-2025095097-A1 Process for producing benzimidazole compound RAQUALIA PHARMA INC. (JP) 2025-05-08 WO disclosed