SCHEMBL6904744

SCHEMBL6904744

O=C1c2cccc(Cl)c2C(c2ccccc2)c2cccc(Cl)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41
CYP1A2 P05177 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPK1 P28482 1/20 0.41
HTR2B P41595 1/20 0.41
PBRM1 Q86U86 3/20 0.39
CACNB4 O00305 1/20 0.37
CACNA1A O00555 1/20 0.37
CACNA1G O43497 1/20 0.37
CACNG3 O60359 1/20 0.37
CACNA1F O60840 1/20 0.37
CACNA1H O95180 1/20 0.37
CACNB3 P54284 1/20 0.37
CACNA2D1 P54289 1/20 0.37
CACNG7 P62955 1/20 0.37
CACNA1B Q00975 1/20 0.37
CACNA1D Q01668 1/20 0.37

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
SCHEMBL6905086 0.88 ADORA2A (0.44) ADORA2ALMNAMAPTCYP1A2TP53
SCHEMBL20902858 0.76 HTR7 (0.43) ADORA2ALMNAHTR2BPBRM1CACNB4
SCHEMBL9122030 0.72 ADORA2A (0.43) ADORA2ALMNAMAPTCYP1A2TP53
SCHEMBL10587799 0.71 ADORA2A (0.50) ADORA2ALMNAMAPTCYP1A2TP53
SCHEMBL6905334 0.69 CACNB4 (0.41) LMNACYP1A2TP53MAPK1PBRM1
SCHEMBL7028632 0.69 PBRM1 (0.41) ADORA2AMAPTCYP1A2MAPK1PBRM1
SCHEMBL125609 0.68 NSD2 (0.55) ADORA2ALMNAMAPTMAPK1ALDH1A1
SCHEMBL7030240 0.68 ALDH1A1 (0.34) ADORA2AMAPTHTR2BPBRM1CACNB4
SCHEMBL11481819 0.68 ADORA2A (0.39) ADORA2AMAPTPBRM1ALDH1A1KDM4E
SCHEMBL7029698 0.67 ALDH1A1 (0.33) ADORA2AMAPTCYP1A2TP53PBRM1

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-6815481-B2 FUSED DIBENZO THERMAL STABILIZERS SUCH AS ANTHRACENE, XANTHENE AND ANTHRONE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-11-09 US disclosed
US-20020032256-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-03-14 US disclosed