SCHEMBL8833289

SCHEMBL8833289

Cc1cc(NC(=O)C2CC2)no1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.66
POLB P06746 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
MAPT P10636 2/20 0.59
RAB9A P51151 4/20 0.57
NPC1 O15118 3/20 0.57
TSHR P16473 2/20 0.57
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
ALDH1A1 P00352 2/20 0.56
EGFR P00533 1/20 0.56
GAA P10253 1/20 0.56
LMNA P02545 1/20 0.55

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
SCHEMBL2322149 0.90 SMN1; SMN2 (0.59) SMN1; SMN2POLBTDP1MAPTRAB9A
SCHEMBL2324701 0.83 SMN1; SMN2 (0.55) SMN1; SMN2POLBTDP1MAPTRAB9A
SCHEMBL29066650 0.82 SMN1; SMN2 (0.60) SMN1; SMN2POLBTDP1MAPTRAB9A
SCHEMBL1888991 0.79 MAPT (0.69) SMN1; SMN2POLBTDP1MAPTRAB9A
Trifluoroacetic Acid SCHEMBL21640604 0.79 POLB (0.51) SMN1; SMN2POLBTDP1MAPTRAB9A
SCHEMBL11120338 0.78 NPC1 (0.68) SMN1; SMN2NPC1EGFR
SCHEMBL1430419 0.77 MAPT (0.67) SMN1; SMN2TDP1MAPTRAB9ANPC1
SCHEMBL4110225 0.76 ALDH1A1 (0.72) POLBTDP1MAPTRAB9ANPC1
SCHEMBL25667855 0.76 ALDH1A1 (0.55) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL21640605 0.76 KMT2A (0.48) SMN1; SMN2POLBTDP1MAPTRAB9A

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
US-5654322-A HYPOTENSIVE AGENTS, CEREBRAL APOPLEXY WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1997-08-05 US disclosed
EP-0656355-A1 BIPHENYLMETHANE DERIVATIVE AND MEDICINE CONTAINING THE SAME WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1995-06-07 EP disclosed