SCHEMBL7438487

SCHEMBL7438487

Nc1ccc(CC2CCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HTR6 P50406 1/20 0.44
GFER P55789 1/20 0.44
CYP3A4 P08684 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LTA4H P09960 1/20 0.44
HRH3 Q9Y5N1 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
EPHX1 P07099 1/20 0.41
GBA1 P04062 1/20 0.41

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
SCHEMBL3155441 0.98 NFE2L2 (0.50) NFE2L2MEN1KMT2AALDH1A1HTR6
SCHEMBL7446113 0.91 MEN1 (0.49) MEN1KMT2AALDH1A1HTR6GFER
SCHEMBL23314833 0.85 GBA1 (0.50) NFE2L2MEN1KMT2AGBA1
SCHEMBL40077 0.83 MEN1 (0.44) MEN1KMT2AALDH1A1HTR6GFER
Ammonia Solution, Strong SCHEMBL14343979 0.81 MEN1 (0.43) MEN1KMT2AALDH1A1HTR6GFER
SCHEMBL2627277 0.81 MEN1 (0.43) MEN1KMT2AALDH1A1HTR6GFER
SCHEMBL1264017 0.81 GBA1 (0.66) MEN1KMT2AALDH1A1HTR6GFER
SCHEMBL21471559 0.80 LMNA (0.47) MEN1KMT2AALDH1A1LTA4HHRH3
SCHEMBL10229753 0.80 LTA4H (0.46) LTA4HHRH3LOXL2GBA1
SCHEMBL21767250 0.79 ALDH1A1 (0.44) NFE2L2MEN1KMT2AALDH1A1HTR6

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-0691966-B1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX INC (US) 1998-09-09 EP disclosed
EP-0691966-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-01-17 EP disclosed
US-5455252-A Antiinflammatory agent, immunosuppressant, antiallergen, skin disorders, bronchodilator, analgesic SYNTEX (U.S.A.) INC. (US) 1995-10-03 US disclosed
WO-1994022852-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1994-10-13 WO disclosed