SCHEMBL17014971

SCHEMBL17014971

Fc1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ CYP1A2 P05177 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ TLR9 Q9NR96 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17014969 0.98 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL17014975 0.98 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL15807436 0.98 ALDH1A1 (0.50) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL17014973 0.98 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL10029849 0.98 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL28035445 0.98 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL15807484 0.98 ALDH1A1 (0.50) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL23988628 0.91 ALDH1A1 (0.56) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL20408053 0.91 ALDH1A1 (0.56) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4
SCHEMBL13721274 0.91 ALDH1A1 (0.56) ALDH1A1L3MBTL1CYP1A2KDM4ECYP3A4

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-20150236267-A1 ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LT.D (KR) 2015-08-20 — — US disclosed
US-20150236267-A1 ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LT.D (KR) 2015-08-20 — — US disclosed
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