SCHEMBL6503978

SCHEMBL6503978

NC(=O)C(C1CCCCC1)C1CCCNC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.68
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
CYP2D6 P10635 1/20 0.47
CPN1 P15169 2/20 0.46
CPB2 Q96IY4 2/20 0.46
APLNR P35414 2/20 0.43
SLC6A1 P30531 2/20 0.40
SLC6A11 P48066 1/20 0.40
TSHR P16473 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SLC6A13 Q9NSD5 1/20 0.40
NOS2 P35228 1/20 0.39
ALDH1A1 P00352 1/20 0.33
GLI1 P08151 1/20 0.32
PIM1 P11309 1/20 0.31
KCNH2 Q12809 1/20 0.31

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
SCHEMBL5178936 0.87 EPHX1 (0.76) EPHX1KDM4EMAPTKMT2AATM
SCHEMBL28324199 0.82 EPHX1 (1.00) EPHX1KDM4EMAPTLMNASMN1; SMN2
SCHEMBL1712104 0.82 EPHX1 (1.00) EPHX1KDM4EMAPTLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL28077546 0.80 EPHX1 (0.95) EPHX1KDM4EMAPTLMNASMN1; SMN2
SCHEMBL2842397 0.80 EPHX1 (0.95) EPHX1ALDH1A1DPP4
Hydrochloric Acid SCHEMBL28819701 0.78 EPHX1 (0.90) EPHX1KDM4EMAPTLMNASMN1; SMN2
SCHEMBL3952207 0.76 KDM4E (0.48) EPHX1KDM4EMAPTKMT2AATM
SCHEMBL28281575 0.74 EPHX1 (0.60) EPHX1KDM4EMAPTKMT2AATM
SCHEMBL1698333 0.73 EPHX1 (0.79) EPHX1TSHRALDH1A1DPP4
SCHEMBL1698331 0.73 EPHX1 (0.79) EPHX1TSHRALDH1A1DPP4

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-2005033068-A1 SOMATOSTATIN RECEPTOR 1 AND/OR 4 SELECTIVE AGONISTS AND ANTAGONISTS OY JUVANTIA PHARMA LTD (FI) 2005-04-14 WO disclosed