SCHEMBL7437849

SCHEMBL7437849

CC=Cc1cc(Br)c2ncccc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 5/20 0.41
MAPT P10636 4/20 0.41
CCR1 P32246 4/20 0.40
CCR8 P51685 4/20 0.40
CCR5 P51681 2/20 0.39
PSMD14 O00487 1/20 0.39
COPS5 Q92905 1/20 0.39
HTT P42858 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
KDM4E B2RXH2 2/20 0.38
TP53 P04637 2/20 0.38
HSP90AA1 P07900 2/20 0.38
GMNN O75496 1/20 0.38
MMP2 P08253 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 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
SCHEMBL4042060 0.80 CCR1 (0.41) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL4037328 0.80 ERN1 (0.42) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL4810431 0.75 CYP1A2 (0.52) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL2696188 0.74 PSMD14 (0.62) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL9130166 0.74 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL6670845 0.72 MEN1 (0.50) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL31276857 0.72 CCR1 (0.46) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL2582442 0.72 CCR1 (0.46) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL21428259 0.71 NPC1 (0.66) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL7195193 0.71 NPC1 (0.66) MEN1KMT2AALDH1A1MAPTHTT

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