SCHEMBL3469082

SCHEMBL3469082

CCC(Cl)C(=O)Nc1ccccc1CC(C)(C)OC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.41
TSHR P16473 3/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KCNQ2 O43526 1/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
POLB P06746 3/20 0.38
MAPK1 P28482 1/20 0.38
NR1H4 Q96RI1 1/20 0.37

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
SCHEMBL9860802 0.82 TAS1R3 (0.55) L3MBTL1TSHRTAS1R3TAS1R1ALDH1A1
SCHEMBL11057176 0.73 PGR (0.57) TSHRALDH1A1LMNAMAPTPOLB
SCHEMBL2802549 0.70 L3MBTL1 (0.45) L3MBTL1TSHRALDH1A1KCNQ2KDM4E
SCHEMBL27473271 0.68 KDM4E (0.49) L3MBTL1TSHRALDH1A1KCNQ2KDM4E
SCHEMBL10584522 0.68 L3MBTL1 (0.58) L3MBTL1TAS1R3TAS1R1ALDH1A1KMT2A
SCHEMBL6901453 0.68 MAPT (0.61) ALDH1A1KMT2ALMNAMAPTPOLB
SCHEMBL16345946 0.67 CYP1A2 (0.55) ALDH1A1KDM4EKMT2ALMNAPOLB
SCHEMBL13469120 0.66 L3MBTL1 (0.70) L3MBTL1TAS1R3TAS1R1ALDH1A1KMT2A
SCHEMBL5152296 0.65 KMT2A (0.63) L3MBTL1TSHRTAS1R3TAS1R1ALDH1A1
SCHEMBL10027969 0.65 KDM4E (0.70) L3MBTL1TSHRALDH1A1KCNQ2KDM4E

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-2010127142-A2 USE OF LIGNOSULFONATES IN SUSPO-EMULSIONS FOR PRODUCING PESTICIDE COMPOSITIONS LIGNOTECH USA, INC. (US) 2010-11-04 WO claimed