SCHEMBL25868374

SCHEMBL25868374

COCCOc1cc(I)cc(I)c1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
POLB P06746 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MAOA P21397 1/20 0.33
DYRK1A Q13627 1/20 0.33
RECQL P46063 1/20 0.33
MAPK14 Q16539 1/20 0.33
MAPK1 P28482 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALDH1A1 P00352 1/20 0.32
PARP1 P09874 1/20 0.32
BRD4 O60885 1/20 0.32
CCL2 P13500 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL16094031 0.82 HTT (0.42) L3MBTL1KDM4EALDH1A1
SCHEMBL670276 0.79 MAPK1 (0.46) L3MBTL1KDM4EMAPK1CYP1A2CYP2D6
SCHEMBL29584039 0.79 MAPK1 (0.46) L3MBTL1KDM4EMAPK1CYP1A2CYP2D6
SCHEMBL4442685 0.79 S1PR4 (0.41) L3MBTL1ALDH1A1CHRNB2CHRNA4
SCHEMBL7002508 0.77 APP (0.52) KDM4ERECQL
SCHEMBL4168797 0.76 ALDH1A1 (0.55) KDM4ERECQLMAPK1CYP1A2CYP2D6
SCHEMBL8969657 0.75 TSHR (0.46) KDM4ERECQLMAPK1CYP1A2CYP2D6
SCHEMBL19399855 0.74 MEN1 (0.45) KDM4EMAOADYRK1AMAPK1CYP1A2
SCHEMBL3440051 0.74 MEN1 (0.49) KDM4EMAOADYRK1AMAPK1ALDH1A1
SCHEMBL14280599 0.74 KDM4E (0.34) L3MBTL1POLBKDM4EMAOADYRK1A

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
US-20230228746-A1 Water-soluble M-conjugated fluorescent 1,1-binaphthyl-based tandem polymers Miltenyi Biotec B.V. & Co. KG (DE) 2023-07-20 US disclosed