SCHEMBL16558191

SCHEMBL16558191

CC1(C)OB(c2cccc3c2oc2c(C#N)cccc23)OC1(C)C

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.32
BTK Q06187 1/20 0.32
LPL P06858 2/20 0.31
LIPG Q9Y5X9 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
ESR2 Q92731 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
SCHEMBL21177656 0.86 LPL (0.39) JAK2BTKLPLLIPGCA1
SCHEMBL24665198 0.85 CYP19A1 (0.32) JAK2BTK
SCHEMBL17441674 0.82 SLC6A2 (0.37) JAK2BTKLPLLIPGCA1
SCHEMBL16560563 0.79 LIPG (0.44) LPLLIPGCA1CA2ESR2
SCHEMBL31355173 0.78 IDO1 (0.36)
SCHEMBL520252 0.78 LPL (0.42) LPLLIPGCA1CA2ESR2
SCHEMBL20211493 0.78 AHR (0.45) JAK2BTKLPLLIPG
SCHEMBL18216768 0.78 LOXL2 (0.36) JAK2BTKLPLLIPG
SCHEMBL25880722 0.78 IDO1 (0.37)
SCHEMBL11554901 0.78 CA1 (0.45) CA1CA2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9825231-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-21 US disclosed
US-9825231-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-21 US disclosed
US-20150069355-A1 CONDENSED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed
US-20150069347-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed
US-20150069347-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed