SCHEMBL7144568

SCHEMBL7144568

ClCCOc1onc2ccccc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
NPC1 O15118 1/20 0.32
TSHR P16473 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
LMNA P02545 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
NCF1 P14598 3/20 0.30
PDE5A O76074 1/20 0.30
ELANE P08246 1/20 0.30

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
SCHEMBL2491455 0.81 FAAH (0.48) FAAHMGLLNPC1TSHRRAB9A
SCHEMBL2494284 0.79 ELANE (0.45) KMT2AFAAHMGLLNPC1TSHR
SCHEMBL2490792 0.72 POLB (0.45) KMT2ANPC1RAB9AALDH1A1HPGD
SCHEMBL31301176 0.69 MAPT (0.50) KMT2ATSHRRAB9AALDH1A1SMN1; SMN2
SCHEMBL3343039 0.69 POLB (0.52) KMT2ANPC1TSHRRAB9AL3MBTL1
SCHEMBL5331706 0.69 FAAH (0.65) FAAHMGLLNPC1TSHRRAB9A
SCHEMBL11165792 0.66 SMN1; SMN2 (0.40) KMT2AL3MBTL1ALDH1A1HPGDSMN1; SMN2
SCHEMBL3716873 0.66 SRC (0.38) KMT2ANPC1TSHRL3MBTL1ALDH1A1
SCHEMBL7217441 0.65 MAOA (0.44) KMT2ATSHRALDH1A1HPGDSMN1; SMN2
SCHEMBL12604032 0.65 IDO1 (0.52) KMT2AL3MBTL1ALDH1A1HPGDSMN1; SMN2

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
EP-1278741-A1 MUSCARINIC AGONISTS Acadia Pharmaceuticals Inc. (US) 2003-01-29 EP disclosed
WO-2001083472-A1 MUSCARINIC AGONISTS ACADIA PHARMACEUTICALS, INC. (US) 2001-11-08 WO disclosed