SCHEMBL10751690

SCHEMBL10751690

c1ccc([C@@H]2CCCCCC[C@@H]2C2CCCCCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CHRNA7 P36544 1/20 0.41
MAOA P21397 9/20 0.40
MAOB P27338 9/20 0.40
KDM1A O60341 8/20 0.40
CYP2C19 P33261 4/20 0.40
CYP2B6 P20813 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2D6 P10635 2/20 0.40
CYP2C9 P11712 2/20 0.40
TAAR1 Q96RJ0 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 1/20 0.40
HTR1A P08908 1/20 0.40
ADRA2A P08913 1/20 0.40
CYP2A6 P11509 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2C P28335 1/20 0.40
ADRA1A P35348 1/20 0.40

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
SCHEMBL10736010 1.00 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL10751693 1.00 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL418730 1.00 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL395631 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL13735039 0.96 MEN1 (0.47) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL6389916 0.88 MEN1 (0.44) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL28843512 0.88 CHRNA7 (0.41) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL20547603 0.83 MAOB (0.45) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL6389922 0.81 HDAC4 (0.42) MEN1KMT2ACHRNA7MAOAMAOB
SCHEMBL27470692 0.81 MEN1 (0.39) MEN1KMT2ACHRNA7MAOAMAOB

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-4705807-A NERVOUS SYSTEM DISORDERS LILLY INDUSTRIES LIMITED (GB) 1987-11-10 US disclosed