SCHEMBL11425084

SCHEMBL11425084

CCN(CC)c1cccc(NC(=O)c2ccccc2Cl)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2R P25116 2/20 0.63
▸ KCNK3 O14649 2/20 0.59
▸ KCNK9 Q9NPC2 2/20 0.59
▸ ALDH1A1 P00352 3/20 0.58
▸ MAPT P10636 3/20 0.56
▸ TP53 P04637 2/20 0.56
▸ NPC1 O15118 2/20 0.56
▸ RAB9A P51151 2/20 0.56
▸ LMNA P02545 1/20 0.56
▸ NFKB1 P19838 1/20 0.56
▸ NFKB2 Q00653 1/20 0.56
▸ RELA Q04206 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.53
▸ SMO Q99835 1/20 0.51

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
SCHEMBL11438420 0.87 MEN1 (0.60) ALDH1A1MAPTTP53NPC1RAB9A
SCHEMBL10894466 0.85 MEN1 (0.62) F2RALDH1A1MAPTTP53NPC1
SCHEMBL11430463 0.85 MEN1 (0.69) F2RKCNK3KCNK9ALDH1A1MAPT
SCHEMBL11412174 0.81 LMNA (0.53) F2RALDH1A1MAPTTP53NPC1
SCHEMBL8356134 0.81 KCNK3 (0.63) KCNK3KCNK9ALDH1A1MAPTTP53
SCHEMBL11427459 0.80 KMT2A (0.61) ALDH1A1MAPTTP53NPC1RAB9A
SCHEMBL10384848 0.80 KCNK3 (0.58) KCNK3ALDH1A1MAPTTP53NPC1
SCHEMBL697935 0.80 ALDH1A1 (0.58) ALDH1A1MAPTTP53NPC1RAB9A
SCHEMBL29594409 0.80 ALDH1A1 (0.58) ALDH1A1MAPTTP53NPC1RAB9A
SCHEMBL882791 0.79 KCNK3 (0.75) F2RKCNK3KCNK9ALDH1A1MAPT

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
US-4240959-A FOR ACRYLONITRILE POLYMER OR COPOLYMER FIBERS; FASTNESS PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1980-12-23 — — US disclosed
Send feedback