SCHEMBL7445231

SCHEMBL7445231

Brc1cc(Cc2ccccc2)cc2cccnc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
NPC1 O15118 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PDE4A P27815 6/20 0.42
PDE4B Q07343 3/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PAX8 Q06710 1/20 0.41
GLO1 Q04760 1/20 0.40
CCR1 P32246 2/20 0.40
CCR8 P51685 2/20 0.40
RAB9A P51151 1/20 0.40
ITK Q08881 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CALM1 P0DP23 1/20 0.39
CYP3A4 P08684 2/20 0.38
MAPT P10636 2/20 0.38
CYP1A2 P05177 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
SCHEMBL665059 0.89 PDE4A (0.53) KDM4ENPC1L3MBTL1PDE4APDE4B
SCHEMBL7449180 0.86 L3MBTL1 (0.45) KDM4ENPC1L3MBTL1PDE4APDE4B
SCHEMBL7441535 0.84 L3MBTL1 (0.44) KDM4ENPC1L3MBTL1PDE4APDE4B
SCHEMBL4034477 0.81 KDM4E (0.42) KDM4ENPC1L3MBTL1PDE4ALMNA
SCHEMBL3712064 0.81 KDM4E (0.43) KDM4ENPC1L3MBTL1PDE4APDE4B
SCHEMBL1060220 0.80 CCR1 (0.42) KDM4ENPC1L3MBTL1PDE4ALMNA
SCHEMBL21438696 0.80 KDM4E (0.41) KDM4ENPC1L3MBTL1PDE4ALMNA
SCHEMBL27513673 0.79 KDM4E (0.39) KDM4ENPC1L3MBTL1LMNASMN1; SMN2
SCHEMBL24368588 0.78 THRB (0.45) KDM4EL3MBTL1PDE4APDE4BPDE4C
SCHEMBL29518290 0.78 THRB (0.45) KDM4EL3MBTL1PDE4APDE4BPDE4C

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