SCHEMBL8978232

SCHEMBL8978232

COc1ccc2[nH]c(C)c(C(C(=O)c3ccc(Cl)cc3)c3cc(=O)n(-c4cccc(C)c4)[nH]3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALKBH5 Q6P6C2 2/20 0.39
▸ PDGFRB P09619 3/20 0.37
▸ FGFR1 P11362 3/20 0.37
▸ KDR P35968 3/20 0.37
▸ TRPV1 Q8NER1 1/20 0.37
▸ PIKFYVE Q9Y2I7 1/20 0.36
▸ VDR P11473 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ TP53 P04637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.33
▸ POLB P06746 1/20 0.33

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
SCHEMBL8978324 0.96 ALKBH5 (0.42) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978312 0.95 ALKBH5 (0.40) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978292 0.93 PDGFRB (0.39) PDGFRBFGFR1KDRTRPV1PIKFYVE
SCHEMBL8978334 0.93 NPSR1 (0.40) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978350 0.92 TRPV1 (0.38) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978352 0.92 ALKBH5 (0.38) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978390 0.92 ALKBH5 (0.38) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978407 0.91 TP53 (0.41) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978368 0.91 ALDH1A1 (0.41) ALKBH5PDGFRBFGFR1KDRTRPV1
SCHEMBL8978300 0.91 PDGFRB (0.40) PDGFRBFGFR1KDRTRPV1PIKFYVE

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
US-5484940-A ULTRAVIOLET RADIATION ABSORBERS FOR PLASTICS, AMYLOID PEPTIDE INHIBITORS, ALZHEIMER*S DISEASE ATHENA NEUROSCIENCES, INC. 1996-01-16 — — US disclosed
Send feedback