SCHEMBL6507388

SCHEMBL6507388

O=Cc1ccc2ccccc2c1-c1c(CBr)ccc2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.38
POLB P06746 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
DNMT1 P26358 1/20 0.38
ERN1 O75460 1/20 0.38
MAPT P10636 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
WDR5 P61964 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP2A6 P11509 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL5691676 0.84 ALDH1A1 (0.48) PTPN1POLBDNMT1MAPTCYP1A2
SCHEMBL29521593 0.84 DNMT1 (0.48) PTPN1POLBMEN1KMT2ADNMT1
SCHEMBL30066580 0.84 ALDH1A1 (0.48) PTPN1POLBDNMT1MAPTCYP1A2
SCHEMBL7643518 0.84 DNMT1 (0.48) PTPN1POLBMEN1KMT2ADNMT1
SCHEMBL3383364 0.76 ERN1 (0.42) PTPN1POLBMEN1KMT2AERN1
SCHEMBL2646500 0.76 ERN1 (0.55) PTPN1POLBMEN1KMT2AERN1
SCHEMBL14321074 0.75 MEN1 (0.41) PTPN1MEN1KMT2ATDP1ALDH1A1
SCHEMBL28960987 0.75 ERN1 (0.58) POLBMEN1KMT2AERN1MAPT
SCHEMBL7777414 0.75 CYP2A6 (0.47) MAPTCYP1A2TDP1ALDH1A1CYP2A6
SCHEMBL10062252 0.75 TSHR (0.47) PTPN1POLBMEN1KMT2ADNMT1

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
WO-2005056543-A2 PROCESS FOR USE IN THE PREPARATION OF OXIRANES FROM ALKENES, AND CATALYSTS FOR USE THEREIN AVECIA PHARMACEUTICALS LIMITED (GB) 2005-06-23 WO disclosed