SCHEMBL8801190

SCHEMBL8801190

Cc1cc(C)cc(COC2C3CCN(CC3)C2C(c2ccccc2)c2ccccc2Cl)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.80

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
Hydrochloric Acid SCHEMBL8801143 0.99 TACR1 (0.78) TACR1
Hydrochloric Acid SCHEMBL8801141 0.99 TACR1 (0.78) TACR1
Hydrochloric Acid SCHEMBL8801149 0.99 TACR1 (0.78) TACR1
L-706125 SCHEMBL8800303 0.89 TACR1 (1.00) TACR1
L-706125 SCHEMBL8799997 0.89 TACR1 (1.00) TACR1
L-706125 SCHEMBL8800749 0.89 TACR1 (1.00) TACR1
L-706125 SCHEMBL8799993 0.89 TACR1 (1.00) TACR1
L-706125 SCHEMBL8800016 0.88 TACR1 (0.98) TACR1
L-706125 SCHEMBL8800931 0.88 TACR1 (0.98) TACR1
L-706125 SCHEMBL8800012 0.88 TACR1 (0.98) TACR1

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
EP-0499313-B1 Azabicyclic compounds, pharmaceutical compositions containing them and their use in therapy MERCK SHARP & DOHME (GB) 1997-06-11 EP claimed
EP-0499313-A1 Azabicyclic compounds, pharmaceutical compositions containing them and their use in therapy MERCK SHARP & DOHME LTD. (GB) 1992-08-19 EP claimed