SCHEMBL28675583

SCHEMBL28675583

C1=CC(c2ccccc2)CC=C1c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.31
KDM1A O60341 2/20 0.31
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
TSHR P16473 1/20 0.30
CFTR P13569 1/20 0.30
GOPC Q9HD26 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
SCHEMBL15079159 0.88 MAOA (0.36) KDM1AMAOAMAOB
SCHEMBL19797512 0.87 GPR88 (0.31) KDM1AMAOB
SCHEMBL18790851 0.86 KDM4E (0.33)
SCHEMBL26901621 0.86 KDM4E (0.33)
SCHEMBL22004444 0.84 TRPA1 (0.37) KDM1ATSHR
SCHEMBL18872866 0.84 HSD17B10 (0.34) RECQLKDM1AMAOBTSHR
SCHEMBL24907909 0.84 NPC1 (0.32)
SCHEMBL13103322 0.84
SCHEMBL25056856 0.83 KDM1A (0.33) KDM1AMAOB
SCHEMBL15494343 0.83 KDM1A (0.33) KDM1AMAOB

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
CN-113956278-A Synthesis method of 5, 5-spirosilafluorene through C-H arylation cyclization reaction 中钢集团南京新材料研究院有限公司 2022-01-21 CN disclosed