SCHEMBL6234948

SCHEMBL6234948

COc1cc(OCc2ccc(SC(F)(F)F)cc2)cc(OC)c1CNCCC(C)Cc1ncc(C)s1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 2/20 0.38
CD274 Q9NZQ7 16/20 0.35
PPARD Q03181 1/20 0.33
PTPN1 P18031 1/20 0.31
NTRK1 P04629 1/20 0.31
CSF1R P07333 1/20 0.31
NTRK2 Q16620 1/20 0.31
PDCD1 Q15116 1/20 0.31

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
SCHEMBL6271288 1.00 PTPRZ1 (0.38) PTPRZ1CD274PPARDPTPN1NTRK1
SCHEMBL6237290 0.89 TMEM97 (0.36) CD274PPARD
SCHEMBL6231278 0.89 PTPRZ1 (0.41) PTPRZ1CD274PPARDPTPN1NTRK1
SCHEMBL6234874 0.82 PTPRZ1 (0.43) PTPRZ1PPARDNTRK1CSF1RNTRK2
SCHEMBL6231277 0.80 PTPRZ1 (0.41) PTPRZ1CD274PPARDNTRK1CSF1R
SCHEMBL6232926 0.79 PTPRZ1 (0.42) PTPRZ1CD274PPARDPDCD1
SCHEMBL6235523 0.78 SMN1; SMN2 (0.43) CD274PDCD1
SCHEMBL6271280 0.78 PTPRZ1 (0.39) PTPRZ1CD274PPARDPDCD1
SCHEMBL6234945 0.78 PTPRZ1 (0.39) PTPRZ1CD274PPARDPDCD1
SCHEMBL6233515 0.76 BCHE (0.41) CD274PDCD1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005000309-A2 CHEMICAL COMPOUNDS IONIX PHARMACEUTICALS LIMITED (GB) 2005-01-06 WO disclosed