SCHEMBL10490263

SCHEMBL10490263

CCc1nccc(-c2ccc(CBr)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 2/20 0.37
KDM4E B2RXH2 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CLK1 P49759 2/20 0.35
CLK2 P49760 2/20 0.35
DYRK1A Q13627 2/20 0.35
CLK4 Q9HAZ1 2/20 0.35
DYRK1B Q9Y463 2/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
NPC1 O15118 4/20 0.33
METAP2 P50579 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 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
SCHEMBL10490481 0.81 MEN1 (0.53) TRPV3KDM4ELMNAMAPTALDH1A1
SCHEMBL14526063 0.79 MAPT (0.51) KDM4ELMNAMAPTALDH1A1CLK1
SCHEMBL10272516 0.79 AURKA (0.53) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL2759646 0.77 NPC1 (0.58) KDM4EMAPTALDH1A1CLK1CLK2
SCHEMBL3970473 0.72 AURKA (0.53) KDM4EMAPTMEN1KMT2ARAB9A
SCHEMBL8842468 0.71 MEN1 (0.50) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL10533031 0.70 RAB9A (0.52) KDM4ELMNAMAPTALDH1A1MEN1
SCHEMBL2759537 0.70 HSP90AA1 (0.58) KDM4ELMNAALDH1A1CLK1HSP90AA1
SCHEMBL22010374 0.70 KMO (0.44) TRPV3KDM4EMAPTALDH1A1MEN1
SCHEMBL30892721 0.69 ADORA2A (0.39) KDM4EALDH1A1MEN1KMT2ARAB9A

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
US-4859670-A 2-Azolylmethyl-2-aryl-1,3-dioxolanes and the salts thereof, agents containing same, and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-22 US disclosed
EP-0237962-A2 2-Azolylmethyl-2-aryl-1,3-dioxolanes and their preparation, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-09-23 EP disclosed