SCHEMBL10933760

SCHEMBL10933760

Cc1cc(O)ccc1NCC1=NCCN1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADRA2C P18825 9/20 0.66
▸ ADRA2B P18089 7/20 0.66
▸ ADRA1A P35348 15/20 0.62
▸ ADRA1D P25100 14/20 0.62
▸ ADRA1B P35368 13/20 0.54
▸ ADRA2A P08913 8/20 0.54

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 SCHEMBL10742586 0.99 ADRA2C (0.64) ADRA2CADRA2BADRA1AADRA1DADRA1B
Hydrochloric Acid SCHEMBL9654070 0.77 ADRA2C (0.65) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL15378775 0.76 MAOA (0.57) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL11008145 0.75 ADRA2C (0.63) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL6366434 0.75 ADRA2B (0.79) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL10965109 0.74 ADRA2C (0.78) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL11227694 0.74 ADRA2C (0.69) ADRA2CADRA2BADRA1AADRA1DADRA1B
Hydrochloric Acid SCHEMBL10743273 0.74 ADRA2C (0.61) ADRA2CADRA2BADRA1AADRA1DADRA1B
SCHEMBL11163458 0.74 NISCH (0.68) ADRA2CADRA2BADRA1AADRA1DADRA1B
Hydrochloric Acid SCHEMBL11164250 0.73 NISCH (0.66) ADRA2CADRA2BADRA1AADRA1DADRA1B

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
WO-1985000366-A1 NEW AMIDINES, PREPARATION PROCESS AND THERAPEUTICAL APPLICATION THEREOF LABORATOIRES CHAUVIN-BLACHE (FR) 1985-01-31 — — WO disclosed
EP-0132190-A1 Amidines, process for their preparation and their therapeutical use LABORATOIRES CHAUVIN S.A. (FR) 1985-01-23 — — EP disclosed
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