SCHEMBL5160117

SCHEMBL5160117

BrCc1ccc(-c2ccccc2)cc1CBr

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DCLRE1A Q6PJP8 1/20 0.43
DCLRE1B Q9H816 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPK1 P28482 1/20 0.42
BACE1 P56817 1/20 0.42
ALOX5 P09917 1/20 0.41
PTPN1 P18031 1/20 0.41
GSK3B P49841 1/20 0.41
CYP1A2 P05177 2/20 0.41
TRPA1 O75762 1/20 0.39
TSHR P16473 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38
MAOA P21397 1/20 0.38
ESR2 Q92731 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL21694445 0.88 GABRA1 (0.33) ALDH1A1TSHRESR2ESR1CYP3A4
SCHEMBL15832277 0.83 CRHBP (0.47) DCLRE1ADCLRE1BALDH1A1MAPK1BACE1
SCHEMBL8540746 0.83 ALDH1A1 (0.44) DCLRE1ADCLRE1BALDH1A1MAPK1BACE1
SCHEMBL20696572 0.83 ALDH1A1 (0.44) DCLRE1ADCLRE1BALDH1A1MAPK1BACE1
SCHEMBL8190312 0.82 HSD11B1 (0.40) DCLRE1ADCLRE1BCYP1A2
SCHEMBL6168537 0.81 ALDH1A1 (0.43) DCLRE1ADCLRE1BALDH1A1MAPK1ALOX5
SCHEMBL5215840 0.81 ESR2 (0.52) DCLRE1ADCLRE1BALDH1A1MAPK1ALOX5
SCHEMBL6772798 0.81 ESR2 (0.47) DCLRE1ADCLRE1BALDH1A1MAPK1BACE1
SCHEMBL31490983 0.81 ERBB2 (0.41) ALDH1A1MAPK1ALOX5PTPN1GSK3B
SCHEMBL6772346 0.81 GAA (0.42) DCLRE1ADCLRE1BALDH1A1MAPK1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1153944-B1 PROPYLENE POLYMER, MOLDED OBJECT THEREOF IDEMITSU KOSAN CO (JP) 2007-01-31 EP disclosed
US-6800706-B1 TRANSPARENT, LOW-TEMPERATURE HEAT-SEALABILITY AND WEAR RESISTANCE; WRAPPING AND PACKAGING FILMS IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-10-05 US disclosed
EP-1153944-A1 PROPYLENE POLYMER, MOLDED OBJECT THEREOF, AND PROCESS FOR PRODUCING PROPYLENE POLYMER IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-11-14 EP disclosed