SCHEMBL9720696

SCHEMBL9720696

Oc1ccccc1CN1CCN(C(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MPO P05164 2/20 0.69
MEN1 O00255 4/20 0.64
KMT2A Q03164 4/20 0.64
ATM Q13315 3/20 0.64
OPRM1 P35372 1/20 0.56
OPRD1 P41143 1/20 0.56
KDM4E B2RXH2 1/20 0.53
FAAH O00519 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HDAC4 P56524 1/20 0.51
KCNH2 Q12809 1/20 0.51
HDAC1 Q13547 1/20 0.51
SLC2A1 P11166 1/20 0.49
IGF1R P08069 1/20 0.49

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
SCHEMBL3967782 0.83 MPO (1.00) MPOKMT2AKDM4EFAAHLMNA
SCHEMBL7435404 0.82 ATM (0.55) MEN1KMT2AATMOPRM1LMNA
SCHEMBL16227069 0.81 KMT2A (0.61) MEN1KMT2AATMOPRM1OPRD1
SCHEMBL16225604 0.81 KMT2A (0.86) MEN1KMT2AATMOPRM1OPRD1
SCHEMBL21658466 0.78 MPO (0.81) MPOATMKDM4EFAAHLMNA
SCHEMBL7311276 0.78 ATM (0.84) MEN1KMT2AATMOPRM1OPRD1
Belarizine SCHEMBL2108057 0.78 ATM (0.73) MEN1KMT2AATMOPRM1OPRD1
SCHEMBL9388542 0.78 MPO (0.88) MPOKMT2AKDM4EFAAHLMNA
SCHEMBL1138133 0.77 KCNH2 (0.59) MEN1KMT2AATMOPRM1LMNA
Hydrochloric Acid SCHEMBL16226937 0.77 ATM (0.82) MEN1KMT2AATMOPRM1OPRD1

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-5142052-A Cationic effect-driven carbinol/amine reaction LABORATOIRES SYNTEX (FR) 1992-08-25 US disclosed