SCHEMBL6384693

SCHEMBL6384693

Fc1cccc(NC2CCN(Cc3ccc(Cl)cc3)CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.66
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 1/20 0.57
POLB P06746 1/20 0.57
ROCK2 O75116 1/20 0.56
ROCK1 Q13464 1/20 0.56
MLNR O43193 7/20 0.53
CYP3A4 P08684 3/20 0.53
CYP2D6 P10635 1/20 0.53
KCNH2 Q12809 1/20 0.53
SIGMAR1 Q99720 4/20 0.53
MEN1 O00255 1/20 0.52
BCHE P06276 1/20 0.52
ACHE P22303 1/20 0.52
BACE1 P56817 1/20 0.52
MCHR1 Q99705 1/20 0.52
UBE2M P61081 1/20 0.52
DCUN1D1 Q96GG9 1/20 0.52
CCR2 P41597 1/20 0.52

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
SCHEMBL5871316 0.90 KDM4E (0.69) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL330906 0.82 ALDH1A1 (0.63) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL330905 0.82 ALDH1A1 (0.63) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL7294507 0.79 KDM4E (0.64) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL924357 0.78 ACHE (0.68) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL7286870 0.77 KDM4E (0.67) KDM4EKMT2AALDH1A1POLBROCK2
SCHEMBL8246483 0.77 KDM4E (0.59) KDM4EKMT2AALDH1A1POLBMLNR
SCHEMBL1704373 0.77 MLNR (0.80) MLNRCYP3A4CYP2D6KCNH2
SCHEMBL1818246 0.77 KDM4E (0.66) KDM4EKMT2AALDH1A1POLBSIGMAR1
SCHEMBL5871587 0.77 KDM4E (0.52) KDM4EKMT2AMLNRCYP3A4CYP2D6

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-1556045-A1 4-AMINOPIPERIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS UCB, S.A. (BE) 2005-07-27 EP disclosed
WO-2004030668-A1 4-AMINOPIPERIDINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS MEDICAMENTS UCB, S.A. (BE) 2004-04-15 WO disclosed