SCHEMBL31363023

SCHEMBL31363023

Cn1ncc(Oc2cccc(Br)c2F)c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.42
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
HPGD P15428 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.33
BTK Q06187 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL31363069 0.81 BTK (0.36) HTTLMNAGAASMN1; SMN2CYP1A2
SCHEMBL31362990 0.75 ICAM1 (0.42) HTTLMNAGAASMN1; SMN2CYP1A2
SCHEMBL1357879 0.72 HTT (0.50) HTTLMNAGAASMN1; SMN2CYP1A2
SCHEMBL31363111 0.72 LMNA (0.42) HTTLMNASMN1; SMN2HPGDKMT2A
SCHEMBL31719628 0.70 PPARG (0.47) GAASMN1; SMN2
SCHEMBL18339396 0.69 ALDH1A1 (0.44) HTTKMT2AMEN1L3MBTL1
SCHEMBL16617320 0.69 L3MBTL1 (0.35) HTTLMNAGAASMN1; SMN2CYP1A2
SCHEMBL1758499 0.69 PKM (0.48) HTR2AHTR2CL3MBTL1
SCHEMBL31719630 0.68 ALDH1A1 (0.43) SMN1; SMN2KMT2AL3MBTL1
SCHEMBL24053551 0.68 NPC1 (0.37) LMNAHPGDKMT2AMEN1

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
WO-2025033011-A1 FIVE-MEMBERED HETEROARYL COMPOUND AND AGRICULTURAL AND HORTICULTURAL BACTERICIDE 日本曹達株式会社 2025-02-13 WO disclosed