SCHEMBL2852963

SCHEMBL2852963

CC(C)N(Cc1ccccc1)C(=O)c1cnn(C)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 3/20 0.51
PSEN2 P49810 3/20 0.51
APH1B Q8WW43 3/20 0.51
NCSTN Q92542 3/20 0.51
APH1A Q96BI3 3/20 0.51
PSENEN Q9NZ42 3/20 0.51
HSD17B10 Q99714 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
ATM Q13315 1/20 0.48
THRB P10828 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43
GPBAR1 Q8TDU6 2/20 0.41
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL2857154 0.83 KMT2A (0.55) MEN1KMT2AKDM4EMAPTALDH1A1
SCHEMBL2854792 0.81 KMT2A (0.49) HSD17B10MEN1KMT2AATMKDM4E
SCHEMBL2855694 0.75 MAPK14 (0.49) HSD17B10MEN1KMT2ATHRBMAPK1
SCHEMBL10050569 0.74 PSEN1 (0.53) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14427596 0.73 MEN1 (0.67) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3456449 0.72 HPGD (0.66) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1701279 0.72 KMT2A (0.76) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL11230693 0.71 MEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3769883 0.71 MEN1 (0.56) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL7972682 0.71 KMT2A (0.69) PSEN1PSEN2APH1BNCSTNAPH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP disclosed