SCHEMBL7698304

SCHEMBL7698304

c1ccc(Oc2ccc(Cc3ccc4ccc5cccc6ccc3c4c56)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SRD5A2 P31213 1/20 0.43
LTA4H P09960 1/20 0.42
GRIN1 Q05586 2/20 0.40
GRIN2B Q13224 2/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL325965 0.85 MEN1 (0.51) MEN1KMT2AKDM4EALDH1A1
SCHEMBL21438669 0.85 MEN1 (0.50) MEN1KMT2AKDM4EALDH1A1
SCHEMBL1812608 0.83 LTA4H (0.47) LTA4HKDM4E
Formaldehyde SCHEMBL29038646 0.81 KMT2A (0.51) MEN1KMT2AKDM4EALDH1A1
SCHEMBL29041190 0.78 MEN1 (0.47) MEN1KMT2AKDM4EALDH1A1
SCHEMBL3930862 0.78 ALDH1A1 (0.48) MEN1KMT2AKDM4EALDH1A1
SCHEMBL25334951 0.76 KMT2A (0.55) MEN1KMT2AKDM4EALDH1A1
SCHEMBL10795218 0.74 CYP1A2 (0.43) MEN1KMT2AALDH1A1
SCHEMBL4614344 0.73 GSTP1 (0.47) LTA4HALDH1A1
SCHEMBL11440835 0.72 CYP1A2 (0.52) MEN1KMT2AALDH1A1

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
EP-1216285-A1 FLUORESCENT MALEIMIDES AND USES THEREOF Ciba SC Holding AG (CH) 2002-06-26 EP disclosed
WO-2001019939-A1 FLUORESCENT MALEIMIDES AND USES THEREOF CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-03-22 WO disclosed