SCHEMBL10690378

SCHEMBL10690378

SC1(C2CCCCC2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
TSHR P16473 2/20 0.34
HSD11B1 P28845 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
ABCB11 O95342 1/20 0.30
CYP1A2 P05177 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CYP3A4 P08684 1/20 0.30
CHRM5 P08912 1/20 0.30
CYP2D6 P10635 1/20 0.30
CHRM1 P11229 1/20 0.30
CYP2C9 P11712 1/20 0.30
CHRM3 P20309 1/20 0.30
DRD1 P21728 1/20 0.30
HRH2 P25021 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HRH1 P35367 1/20 0.30

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
SCHEMBL24791554 1.00 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL25128703 0.79
Iodide SCHEMBL11759002 0.76 ALDH1A1 (0.40)
SCHEMBL22591947 0.71
SCHEMBL18419999 0.71 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL18419943 0.71 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL3821667 0.71 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL18419965 0.71 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL2971736 0.71 LMNA (0.34) LMNATSHRHSD11B1KDM4EMAPT
SCHEMBL17208563 0.70

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
EP-0283857-A1 Benzylidenamino, benzylamino and benzoylamino imidazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 1988-09-28 EP disclosed