SCHEMBL11047575

SCHEMBL11047575

Cc1cccc(C)c1Cc1nc[nH]c1C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.51
HRH2 P25021 1/20 0.48
HRH1 P35367 1/20 0.48
HRH4 Q9H3N8 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
TDP1 Q9NUW8 1/20 0.47
HTR3A P46098 5/20 0.47
GABRR1 P24046 1/20 0.46
AR P10275 1/20 0.45
HTR1D P28221 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
CD44 P16070 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FDPS P14324 1/20 0.40
ACP1 P24666 1/20 0.40
PARP1 P09874 2/20 0.40

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
SCHEMBL10741491 0.85 HRH2 (0.55) TAAR1HRH2HRH1HRH4HRH3
SCHEMBL11047774 0.82 HTR3A (0.46) TAAR1HRH2HRH1HRH4HRH3
SCHEMBL11046386 0.81 HTR3A (0.48) HRH2HRH1HRH4HRH3TDP1
SCHEMBL11102609 0.77 HTR3A (0.54) TAAR1HRH2HRH1HRH4HRH3
SCHEMBL10881527 0.75 HRH2 (0.43) TAAR1HRH2HRH1HRH4HRH3
SCHEMBL10743073 0.73 HRH2 (0.53) TAAR1HRH2HRH1HRH4HRH3
SCHEMBL12301245 0.73 HTR3A (0.44) HRH2HRH1HRH4HRH3TDP1
SCHEMBL10885778 0.72 TP53 (0.47) HRH2HRH1HRH4HRH3TDP1
SCHEMBL9519546 0.72 GABRR1 (0.41) HRH2HRH1HRH4HRH3TDP1
SCHEMBL5250399 0.71 TAAR1 (0.50) TAAR1TDP1ARHTR1DCD44

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP claimed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP claimed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP disclosed