SCHEMBL17522044

SCHEMBL17522044

c1ccc(-c2ccc3ccc4c(-c5ccc6c(c5)c5cccnc5n6-c5ccccn5)ccc5ccc2c3c54)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ LMNA P02545 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAT2A P31153 2/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ UHRF1 Q96T88 1/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ PLAUR Q03405 1/20 0.33
▸ NOX4 Q9NPH5 1/20 0.32
▸ NOX1 Q9Y5S8 1/20 0.32
▸ GAA P10253 2/20 0.32
▸ MARS1 P56192 1/20 0.31

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
SCHEMBL17522030 0.99 ALDH1A1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522027 0.97 ALDH1A1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522036 0.94 MEN1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522048 0.94 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522029 0.93 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522022 0.92 MAT2A (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522026 0.92 ALDH1A1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522034 0.91 MAT2A (0.34) ALDH1A1MAT2AKDM4EMAPK1PTGER4
SCHEMBL17522023 0.90 MAT2A (0.34) ALDH1A1MAT2APTGER4IRAK4
SCHEMBL17522049 0.89 ALDH1A1 (0.44) ALDH1A1TSHRCYP2C19PTGER4

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
US-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 — — US disclosed
US-20160043327-A1 ORGANIC LIGHT EMITTING DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2016-02-11 — — US disclosed
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