SCHEMBL8963194

SCHEMBL8963194

CCOCc1ccc(C2CCC(/C=C/Cl)CC2)nc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 5/20 0.38
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AVPR1A P37288 1/20 0.32
IDO1 P14902 1/20 0.31
PDE10A Q9Y233 1/20 0.30
NTRK1 P04629 1/20 0.30
NTRK2 Q16620 1/20 0.30
KIT P10721 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
SCHEMBL8963199 1.00 CSF1R (0.38) CSF1RMEN1KMT2AL3MBTL1AVPR1A
SCHEMBL8963209 0.90 CSF1R (0.35) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8963204 0.90 CSF1R (0.35) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8963068 0.87 MEN1 (0.35) CSF1RMEN1KMT2AL3MBTL1PDE10A
SCHEMBL8963073 0.87 MEN1 (0.35) CSF1RMEN1KMT2AL3MBTL1PDE10A
SCHEMBL8963379 0.85 PDE10A (0.37) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8963382 0.85 PDE10A (0.37) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8962756 0.83 SMN1; SMN2 (0.35) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8962748 0.83 SMN1; SMN2 (0.35) CSF1RMEN1KMT2AL3MBTL1IDO1
SCHEMBL8963235 0.83 AVPR1A (0.31) AVPR1A

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-0559860-B1 HALOVINYL-DERIVATIVES HOFFMANN LA ROCHE (CH) 1996-02-14 EP disclosed
US-5364556-A Halovinyl-derivatives HOFFMANN-LA ROCHE INC. (US) 1994-11-15 US disclosed