SCHEMBL8988366

SCHEMBL8988366

O=C(Nc1ccccc1)c1cccc(Cl)c1OBr

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 5/20 0.55
KCNK3 O14649 1/20 0.55
KCNK9 Q9NPC2 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 1/20 0.51
MAPT P10636 2/20 0.51
JAK2 O60674 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
TYK2 P29597 1/20 0.51
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
BDKRB1 P46663 1/20 0.51
HPGD P15428 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL8469266 0.86 SMO (0.56) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL28017780 0.85 SMO (0.55) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL28913528 0.85 SMO (0.55) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL3441194 0.83 KMT2A (0.68) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL1203522 0.80 SMO (0.80) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL4155586 0.79 JAK2 (0.73) SMOKCNK3KCNK9MEN1KMT2A
Water SCHEMBL27602058 0.79 SMO (0.77) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL28288294 0.79 TSHR (0.57) MEN1KMT2AALDH1A1MAPTMAPK1
SCHEMBL3791414 0.78 SMO (0.61) SMOKCNK3KCNK9MEN1KMT2A
SCHEMBL5852388 0.78 KLKB1 (0.72) SMOKCNK3KCNK9MEN1KMT2A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5565146-A Light duty liquid detergent compositions COLOGATE-PALMOLIVE CO. (US) 1996-10-15 US disclosed
EP-0487169-B1 Concentrated liquid detergent composition containing alkyl benzene sulfonate and magnesium COLGATE PALMOLIVE CO (US) 1996-08-21 EP disclosed
EP-0509608-B1 Light duty liquid detergent compositions COLGATE PALMOLIVE CO (US) 1996-07-10 EP disclosed
US-5480586-A WITH LINEAR AKKYL BENZENE SULFONATE/ALKYL ETHER SULFATE ANIONIC SURFACTANTS, ALKYL ETHER POLYGLUCOSIDE, ALKANOLAMIDE FOAM STABILIZER; HANDWASHING DISHWARE COLGATE-PALMOLIVE CO. (US) 1996-01-02 US disclosed
US-5424010-A Light duty liquid detergent composition containing 3-methyl-3-methoxy-butanol DULIBA EDWARD P (US) 1995-06-13 US disclosed
EP-0509608-A2 Light duty liquid detergent compositions Colgate-Palmolive Company (US) 1992-10-21 EP disclosed
EP-0487169-A1 Concentrated liquid detergent composition containing alkyl benzene sulfonate and magnesium Colgate-Palmolive Company (a Delaware corporation) (US) 1992-05-27 EP disclosed
EP-0431050-A1 LIGHT DUTY LIQUID DETERGENT COMPOSITIONS Colgate-Palmolive Company (US) 1991-06-12 EP disclosed
WO-1990002164-A1 LIGHT DUTY LIQUID DETERGENT COMPOSITIONS COLGATE PALMOLIVE COMPANY (US) 1990-03-08 WO disclosed