SCHEMBL9302324

SCHEMBL9302324

Fc1ccccc1CN1CCC(CNCC2COc3ccccc3O2)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRA1D P25100 12/20 0.62
ADRA1A P35348 12/20 0.62
ADRA1B P35368 12/20 0.62
KMT2A Q03164 1/20 0.51
HTR1A P08908 1/20 0.49
HTR7 P34969 1/20 0.49
ATM Q13315 1/20 0.49
HPGD P15428 1/20 0.47
TSHR P16473 1/20 0.47

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
SCHEMBL9301658 0.88 ADRA1D (0.64) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL9303125 0.80 ADRA1D (0.63) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL9302670 0.79 ADRA1D (0.60) ADRA1DADRA1AADRA1BHTR1AHTR7
SCHEMBL9303150 0.78 ADRA1D (0.59) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL9302823 0.78 ADRA1D (0.62) ADRA1DADRA1AADRA1BHTR1AATM
SCHEMBL9302789 0.78 ADRA1D (0.56) ADRA1DADRA1AADRA1BKMT2AHTR1A
SCHEMBL7471573 0.77 ADRA1D (1.00) ADRA1DADRA1AADRA1BHTR1AHPGD
Hydrochloric Acid SCHEMBL8124825 0.76 ADRA1D (0.98) ADRA1DADRA1AADRA1BHTR1AHPGD
SCHEMBL9300949 0.76 ADRA1D (0.66) ADRA1DADRA1AADRA1BHTR1A
SCHEMBL9301600 0.76 ADRA1D (0.74) ADRA1DADRA1AADRA1BKMT2AHTR1A

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-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US claimed
US-5286735-A Antidepressants, anxiolytic agents PIERRE FABRE MEDICAMENT (FR) 1994-02-15 US disclosed