SCHEMBL22270563

SCHEMBL22270563

CCCc1ccc(CC(Nc2ccc(-c3nccnc3-c3ccccc3)cc2)=C2CCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 1/20 0.39
▸ DGAT1 O75907 1/20 0.37
▸ KDR P35968 1/20 0.36
▸ PDE10A Q9Y233 2/20 0.36
▸ RORC P51449 2/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ NR1H4 Q96RI1 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ NPY2R P49146 1/20 0.34
▸ NISCH Q9Y2I1 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ HTT P42858 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
SCHEMBL22270537 0.89 MAPT (0.36) WNT3ADGAT1KDRPDE10AMEN1
SCHEMBL22270880 0.89 LMNA (0.37) WNT3AKDRMEN1KMT2ALMNA
SCHEMBL22270671 0.85 RORC (0.39) WNT3AKDRPDE10ARORCHTT
SCHEMBL22270885 0.84 RORC (0.35) KDRPDE10ARORCLMNAMAPT
SCHEMBL22270668 0.83 KDR (0.36) WNT3AKDRPDE10ARORCMEN1
SCHEMBL22271066 0.82 RORC (0.35) RORCMAPT
SCHEMBL22271062 0.81 LPAR1 (0.35) KDRRORC
SCHEMBL22271048 0.80 PDGFRB (0.41) WNT3ALMNAMAPTTP53KDM4E
SCHEMBL22270887 0.79 KDM4E (0.40) MAPTKDM4EHTT
SCHEMBL18485956 0.79 WNT3A (0.35) WNT3APDE10ARORCMEN1KMT2A

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
EP-3686187-A1 PROCESS FOR THE PREPARATION OF ROR GAMMA MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2020-07-29 — — EP disclosed
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