SCHEMBL16985990

SCHEMBL16985990

CC1(C)OB(c2cc3ccccc3c3c2c2ccccc2n3-c2ccccc2)OC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ LPL P06858 2/20 0.34
▸ LIPG Q9Y5X9 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ BRCA1 P38398 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ JAK2 O60674 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ MAPK8 P45983 2/20 0.31
▸ MAPK9 P45984 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ HKDC1 Q2TB90 1/20 0.30

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
SCHEMBL19849971 0.91 KDM4E (0.38) KDM4EATML3MBTL1LPLLIPG
SCHEMBL19786335 0.87 LPL (0.36) LPLLIPGALDH1A1JAK2BTK
SCHEMBL21109821 0.86 KDM4E (0.41) KDM4EATML3MBTL1LPLLIPG
SCHEMBL29684308 0.86 KDM4E (0.41) KDM4EATML3MBTL1LPLLIPG
SCHEMBL18593675 0.81 ALDH1A1 (0.34) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL2627618 0.81 KDM4E (0.37) KDM4EATML3MBTL1LPLLIPG
SCHEMBL19573579 0.79 JAK2 (0.34) KDM4EATML3MBTL1LPLLIPG
SCHEMBL15533585 0.79 KDM4E (0.44) KDM4EATML3MBTL1LPLLIPG
SCHEMBL16985692 0.79 KDM4E (0.44) KDM4EATML3MBTL1LPLLIPG
SCHEMBL16598107 0.78 KDM4E (0.46) KDM4EATML3MBTL1LPLLIPG

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-2015115756-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2015-08-06 — — WO disclosed
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