SCHEMBL7184664

SCHEMBL7184664

CCCCCCCCCCCCCCc1ccccc1.CCCCCCCCCc1ccccc1CCCCCCCCC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.62
LIPG Q9Y5X9 1/20 0.58
SIGMAR1 Q99720 5/20 0.55
HTR2A P28223 2/20 0.54
ESR1 P03372 2/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
TACR2 P21452 2/20 0.53
SLC6A2 P23975 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
SHBG P04278 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
HSPD1 P10809 1/20 0.53
ADRB3 P13945 1/20 0.53
HTR2C P28335 1/20 0.53

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
SCHEMBL27378152 1.00 KCNH2 (0.62) KCNH2LIPGSIGMAR1HTR2AESR1
SCHEMBL15662944 1.00 KCNH2 (0.62) KCNH2LIPGSIGMAR1HTR2AESR1
SCHEMBL27670849 0.94 KCNH2 (0.57) KCNH2LIPGSIGMAR1HTR2A
SCHEMBL7204684 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
Decane SCHEMBL8740719 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL8678238 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL57721 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL133045 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL10995503 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A
SCHEMBL8678547 0.91 KCNH2 (0.71) KCNH2SIGMAR1HTR2AESR1ADRA2A

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-20030171225-A1 Modified polyisobutylene succinimide dispersants having improved seal, sludge, and deposit performance THE LUBRIZOL CORPORATION 2003-09-11 US disclosed