SCHEMBL10633367

SCHEMBL10633367

CCCNC(=O)C(C#N)(CC)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 1/20 0.46
CNR1 P21554 3/20 0.40
CNR2 P34972 3/20 0.40
POLB P06746 3/20 0.40
ALDH1A1 P00352 3/20 0.40
RIPK1 Q13546 1/20 0.38
MCL1 Q07820 1/20 0.37
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36

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
SCHEMBL701485 0.79 ALDH1A1 (0.41) L3MBTL1LMNAHTTALDH1A1KMT2A
SCHEMBL27560876 0.78 MAPT (0.40) L3MBTL1LMNAHTTALDH1A1KMT2A
SCHEMBL10636185 0.76 MAPT (0.40) L3MBTL1LMNAHTTALDH1A1KMT2A
SCHEMBL119698 0.76 MAPT (0.47) LMNAHTTALDH1A1KMT2AKDM4E
SCHEMBL10988395 0.76 MAPT (0.40) L3MBTL1LMNAHTTALDH1A1KMT2A
SCHEMBL10635869 0.76 MAPT (0.40) L3MBTL1LMNAHTTALDH1A1KMT2A
SCHEMBL6435539 0.74 CNR1 (0.67) L3MBTL1LMNAHTTCNR1CNR2
SCHEMBL20077094 0.74 LMNA (0.53) L3MBTL1LMNAHTTCNR1CNR2
SCHEMBL6188978 0.73 LMNA (0.55) L3MBTL1LMNAHTTCNR1CNR2
SCHEMBL9214363 0.73 CCR1 (0.50) LMNACNR2POLBALDH1A1KMT2A

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-4740228-A Plant growth regulating compounds and compositions and a process for the preparation thereof EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1988-04-26 US disclosed