SCHEMBL14970547

SCHEMBL14970547

Cc1ccc(C(C)C)c(OCCN2CCCCCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.66
ADRB2 P07550 2/20 0.65
ATM Q13315 3/20 0.63
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
KDM4E B2RXH2 5/20 0.61
HTT P42858 3/20 0.58
ALDH1A1 P00352 3/20 0.57
TSHR P16473 2/20 0.57
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
L3MBTL1 Q9Y468 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
SCHEMBL9627975 0.99 ATM (0.65) SMN1; SMN2ADRB2ATMMEN1KMT2A
Hydrochloric Acid SCHEMBL10546962 0.97 ATM (0.67) SMN1; SMN2ADRB2ATMMEN1KMT2A
SCHEMBL14970553 0.93 KDM4E (0.66) SMN1; SMN2ADRB2ATMMEN1KMT2A
SCHEMBL9195310 0.85 ATM (0.60) SMN1; SMN2ADRB2ATMMEN1KMT2A
SCHEMBL9741116 0.84 ATM (0.59) SMN1; SMN2ADRB2ATMMEN1KMT2A
SCHEMBL9739717 0.82 ATM (0.62) SMN1; SMN2ADRB2ATMMEN1KMT2A
Hydrochloric Acid SCHEMBL9736847 0.81 ATM (0.64) SMN1; SMN2ADRB2ATMMEN1KMT2A
Hydrochloric Acid SCHEMBL9736860 0.81 ATM (0.64) SMN1; SMN2ADRB2ATMMEN1KMT2A
SCHEMBL14970683 0.81 L3MBTL1 (0.71) SMN1; SMN2MEN1KMT2AKDM4EHTT
SCHEMBL806900 0.81 L3MBTL1 (0.71) SMN1; SMN2MEN1KMT2AKDM4EHTT

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-2013074965-A1 AMINOALKYL PHENOL ETHER INHIBITORS OF INFLUENZA A VIRUS MICROBIOTIX, INC. (US) 2013-05-23 WO disclosed