SCHEMBL10408879

SCHEMBL10408879

CNCCN1CCC(=C2c3ccccc3CCc3ccc(F)cc32)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SETD7 Q8WTS6 4/20 0.51
▸ PTAFR P25105 2/20 0.43
▸ KCNH2 Q12809 4/20 0.43
▸ CHRM2 P08172 3/20 0.43
▸ HTR1A P08908 3/20 0.43
▸ CHRM1 P11229 3/20 0.43
▸ DRD2 P14416 3/20 0.43
▸ HTR2A P28223 3/20 0.43
▸ HTR2C P28335 3/20 0.43
▸ ADRA1A P35348 3/20 0.43
▸ HRH1 P35367 3/20 0.43
▸ OPRK1 P41145 3/20 0.43
▸ HTR2B P41595 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ SLC6A2 P23975 3/20 0.43
▸ ADRB2 P07550 2/20 0.43
▸ ADRA2A P08913 2/20 0.43
▸ ADRA2B P18089 2/20 0.43
▸ ADRA2C P18825 2/20 0.43
▸ DRD1 P21728 2/20 0.43

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
SCHEMBL10408874 0.85 SETD7 (0.54) SETD7KCNH2CHRM2HTR1ACHRM1
SCHEMBL11600653 0.82 PTAFR (0.52) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL10409954 0.78 PTAFR (0.48) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL10465365 0.78 PTAFR (0.48) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL10409953 0.75 SETD7 (0.67) SETD7KCNH2CHRM2HTR1ACHRM1
SCHEMBL10465366 0.74 PTAFR (0.42) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL10409038 0.72 SETD7 (0.45) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL6808721 0.71 SETD7 (0.65) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL7817056 0.70 SETD7 (1.00) SETD7PTAFRKCNH2CHRM2HTR1A
SCHEMBL9035820 0.70 SETD7 (0.73) SETD7PTAFRKCNH2CHRM2HTR1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4929621-A ANTIDEPRESSANTS, ANXIOLYTIC AGENTS SYNTHELABO (FR) 1990-05-29 — — US disclosed
US-4891376-A MIGRAINE SYNTHELABO (FR) 1990-01-02 — — US disclosed
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