SCHEMBL9819645

SCHEMBL9819645

O=C(CCl)NCCNc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
MAPT P10636 5/20 0.55
ALDH1A1 P00352 4/20 0.55
POLB P06746 3/20 0.55
MAPK1 P28482 3/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
BLM P54132 2/20 0.55
EGFR P00533 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
RAD52 P43351 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
LMNA P02545 1/20 0.55
HTT P42858 1/20 0.55
RECQL P46063 1/20 0.55
MAOA P21397 1/20 0.51
NSD2 O96028 2/20 0.50
RXFP1 Q9HBX9 2/20 0.50
FGB P02675 1/20 0.50
MMP14 P50281 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
SCHEMBL9819774 0.92 MEN1 (0.60) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL3381039 0.82 MAOA (0.65) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL4732858 0.82 MAPT (0.59) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL8602603 0.80 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL28768751 0.80 MAOA (0.55) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL4732627 0.79 MEN1 (0.72) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL20334297 0.79 NQO1 (0.60) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL6937224 0.79 MEN1 (0.64) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL30237872 0.78 MEN1 (0.80) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL16222322 0.78 MEN1 (0.80) MEN1KMT2AMAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5009880-A Mixture of an anionic and cationic polymer for shampoos, skin lotions, nail strengtheners and hair dyeing; improved fixing and anchoring; smoothness; gloss L'OREAL (FR) 1991-04-23 US disclosed
US-4719099-A ANIONIC AND CATIONIC L'OREAL (FR) 1988-01-12 US disclosed
US-4445521-A ANIONIC AND CATIONIC POLYMER COMBINATION L'OREAL (FR) 1984-05-01 US disclosed
US-4240450-A HAIR CONDITIONER OF ANIONIC POLYMERS AND CATIONIC POLYMERS L'OREAL (FR) 1980-12-23 US disclosed