SCHEMBL17522027

SCHEMBL17522027

c1ccc(-c2ccc3ccc4c(-c5ccc(-c6ccc7c(c6)c6cccnc6n7-c6ccccn6)cc5)ccc5ccc2c3c54)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ UHRF1 Q96T88 1/20 0.35
▸ PIK3CA P42336 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ SLC11A2 P49281 1/20 0.34
▸ MAT2A P31153 2/20 0.33
▸ FFAR4 Q5NUL3 6/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAU P00749 1/20 0.33

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
SCHEMBL17522044 0.97 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522030 0.96 ALDH1A1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522026 0.95 ALDH1A1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522023 0.93 MAT2A (0.34) ALDH1A1IRAK4MAT2APTGER4
SCHEMBL17522036 0.93 MEN1 (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522048 0.90 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522029 0.89 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17522028 0.89 ALDH1A1 (0.44) ALDH1A1TSHRCYP2C19PIK3CAPTGER4
SCHEMBL17522022 0.88 MAT2A (0.35) ALDH1A1TSHRCYP2C19MEN1LMNA
SCHEMBL17124055 0.88 ALDH1A1 (0.40) ALDH1A1TSHRCYP2C19MEN1LMNA

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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