SCHEMBL29200410

SCHEMBL29200410

O=C(Nc1cccc(CCl)c1)c1ccccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 2/20 0.65
KCNK9 Q9NPC2 2/20 0.65
F2R P25116 1/20 0.61
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
MAPT P10636 1/20 0.58
ALDH1A1 P00352 3/20 0.56
SMO Q99835 2/20 0.56
RXFP1 Q9HBX9 1/20 0.54
PAX8 Q06710 1/20 0.54
JAK2 O60674 1/20 0.54
TYK2 P29597 1/20 0.54
CYP11B2 P19099 1/20 0.54
PTGES O14684 1/20 0.53

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
SCHEMBL30802662 1.00 KCNK3 (0.65) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL29200422 0.88 KCNK3 (0.65) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL30802677 0.88 KCNK3 (0.65) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL29200425 0.84 F2R (0.64) F2RMEN1KMT2AALDH1A1RXFP1
SCHEMBL30802666 0.84 F2R (0.64) F2RMEN1KMT2AALDH1A1RXFP1
SCHEMBL27817729 0.83 SMO (0.68) MEN1KMT2AMAPTALDH1A1SMO
SCHEMBL15778718 0.81 FADS1 (0.74) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL27336831 0.81 MEN1 (0.58) KCNK3KCNK9MEN1KMT2AMAPT
SCHEMBL882791 0.80 KCNK3 (0.75) KCNK3KCNK9F2RMEN1KMT2A
SCHEMBL29200346 0.79 PARP1 (0.65) KCNK3KCNK9F2RMEN1KMT2A

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
CN-117658868-A Benzamide derivative and preparation method and application thereof 中山大学 2024-03-08 CN disclosed