SCHEMBL21098358

SCHEMBL21098358

CC[C@@H]1CCCCCCCN(S)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.43
ADRA2C P18825 1/20 0.43
CYP1A2 P05177 2/20 0.38
ACHE P22303 1/20 0.38
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD11B1 P28845 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL11973906 0.80
SCHEMBL18481332 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
SCHEMBL18078965 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
Cyclohexane SCHEMBL10836383 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
SCHEMBL1437788 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
SCHEMBL25446788 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
SCHEMBL4576671 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
Cyclohexane SCHEMBL8731700 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
Cyclopentane SCHEMBL9453150 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2
SCHEMBL3032796 0.80 CYP1A2 (0.52) CHRM5ADRA2CCYP1A2ACHECHRM2

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-3499597-A1 ELECTRON SPECIFIC OXIDE DOUBLE LAYER CONTACTS FOR HIGHLY EFFICIENT AND UV STABLE PEROVSKITE DEVICE Ecole Polytechnique Fédérale de Lausanne (EPFL) (CH) 2019-06-19 EP disclosed