SCHEMBL7841936

SCHEMBL7841936

O=C(NCC(O)Cc1ccc(Cl)cc1)c1c[nH]c2ccc(C#CCO)cc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 3/20 0.43
POLB P06746 1/20 0.39
ADORA2A P29274 2/20 0.39
ADORA1 P30542 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL7841393 0.87 NHERF1 (0.42) NHERF1POLB
SCHEMBL7842249 0.87 NHERF1 (0.40) NHERF1POLBADORA2AADORA1
SCHEMBL7846556 0.83 LMNA (0.41) NHERF1POLBMEN1KMT2A
SCHEMBL7843694 0.76 GAA (0.46) POLB
SCHEMBL7843172 0.76 GABRA1 (0.40)
SCHEMBL7834375 0.75 GABRA1 (0.39) POLB
SCHEMBL6670139 0.75 CFTR (0.39) NHERF1POLB
SCHEMBL7833923 0.75 CFTR (0.45) NHERF1POLB
SCHEMBL7860741 0.74 GABRA1 (0.39) POLB
SCHEMBL7835904 0.74 GABRA1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140851-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP disclosed
EP-1140850-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2001-10-10 EP disclosed
WO-2000040563-A1 4-OXO-1,4-DIHYDRO-3-QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO disclosed
WO-2000040561-A1 QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2000-07-13 WO disclosed