SCHEMBL7309986

SCHEMBL7309986

O=C(O)CCNC(=O)C(Cc1ccc(-c2ccccc2)cc1)N(c1ccccc1)C(c1ccccc1)P(=O)(O)O

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMEL1 Q495T6 1/20 0.55
ACP3 P15309 1/20 0.44
ADCY6 O43306 1/20 0.44
ADCY3 O60266 1/20 0.44
ADCY9 O60503 1/20 0.44
ADCY5 O95622 1/20 0.44
ADCY8 P40145 1/20 0.44
GCGR P47871 1/20 0.44
ADCY7 P51828 1/20 0.44
ADCY2 Q08462 1/20 0.44
ADCY1 Q08828 1/20 0.44
ADCY4 Q8NFM4 1/20 0.44

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
SCHEMBL7310813 1.00 MMEL1 (0.55) MMEL1ACP3ADCY6ADCY3ADCY9
SCHEMBL7312217 1.00 MMEL1 (0.55) MMEL1ACP3ADCY6ADCY3ADCY9
SCHEMBL7309977 0.94 MMEL1 (0.48) MMEL1
SCHEMBL7314736 0.94 MMEL1 (0.48) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7340648 0.94 MMEL1 (0.48) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7314996 0.94 MMEL1 (0.47) MMEL1ACP3
SCHEMBL7320018 0.92 MMEL1 (0.46) MMEL1ACP3
SCHEMBL7311820 0.91 MMEL1 (0.50) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7318929 0.91 MMEL1 (0.50) MMEL1ADCY6ADCY3ADCY9ADCY5
SCHEMBL7318645 0.91 MMEL1 (0.50) MMEL1ADCY6ADCY3ADCY9ADCY5

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-5155100-A Treating cardiovascular disorders in mammals CIBA-GEIGY CORPORATION (US) 1992-10-13 US claimed