SCHEMBL17227644

SCHEMBL17227644

CC1(C)c2cccnc2-c2ncc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ PTGDR2 Q9Y5Y4 2/20 0.31
▸ FEN1 P39748 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ OXTR P30559 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ PDK2 Q15119 1/20 0.30
▸ CKS1B P61024 1/20 0.30
▸ SKP1 P63208 1/20 0.30
▸ SKP2 Q13309 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
SCHEMBL20077335 0.83 ALDH1A1 (0.34) CYP1A2CYP2C19KMT2APTGDR2KDM4E
SCHEMBL17701460 0.82 CYP1A2 (0.39) CYP1A2CYP2C19KMT2APTGS1PTGS2
SCHEMBL20066660 0.81 CYP1A2 (0.35) CYP1A2CYP2C19KMT2APDK2
SCHEMBL17701464 0.81 CYP1A2 (0.35) CYP1A2CYP2C19KMT2APTGS1PTGS2
SCHEMBL15892419 0.80 CYP1A2 (0.38) CYP1A2CYP2C19KMT2APTGS1PTGS2
SCHEMBL17701441 0.79 CYP1A2 (0.39) CYP1A2CYP2C19KMT2APTGS1PTGS2
SCHEMBL18268712 0.77 CYP1A2 (0.30) CYP1A2CYP2C19KMT2APDK2
SCHEMBL24861545 0.76 CYP1A2 (0.38) CYP1A2CYP2C19KMT2APTGS1PTGS2
SCHEMBL20066661 0.75 CYP1A2 (0.33) CYP1A2CYP2C19KMT2APDK2
SCHEMBL20066662 0.75 CYP1A2 (0.32) CYP1A2CYP2C19KMT2APDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9728729-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-08-08 — — US disclosed
US-9728729-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2017-08-08 — — US disclosed
US-20150318511-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-05 — — US disclosed
US-20150318486-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-05 — — US disclosed
US-20150318511-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-05 — — US disclosed
US-20150318486-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2015-11-05 — — US disclosed
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