SCHEMBL17961923

SCHEMBL17961923

Brc1ccc(N(c2ccccc2)c2ccc3c(c2)CC3)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.39
▸ TDP1 Q9NUW8 3/20 0.39
▸ L3MBTL1 Q9Y468 3/20 0.39
▸ MAPT P10636 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B3 P37058 5/20 0.38
▸ MAPK1 P28482 2/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ HTR2C P28335 1/20 0.33
▸ HTR2B P41595 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
SCHEMBL17841776 0.93 PNMT (0.37) ALDH1A1TDP1L3MBTL1MAPTHSD17B3
SCHEMBL2607597 0.93 PNMT (0.37) ALDH1A1TDP1L3MBTL1MAPTHSD17B3
SCHEMBL14506989 0.93 PNMT (0.37) ALDH1A1TDP1L3MBTL1MAPTHSD17B3
SCHEMBL14506990 0.91 ALDH1A1 (0.46) ALDH1A1TDP1L3MBTL1MAPTKDM4E
SCHEMBL11898477 0.91 ALDH1A1 (0.46) ALDH1A1TDP1L3MBTL1MAPTKDM4E
SCHEMBL17841771 0.91 ALDH1A1 (0.46) ALDH1A1TDP1L3MBTL1MAPTKDM4E
SCHEMBL14226932 0.84 ALDH1A1 (0.45) ALDH1A1L3MBTL1MAPTKDM4ECYP1A2
SCHEMBL9811505 0.84 CYP1A2 (0.43) ALDH1A1TDP1L3MBTL1MAPTKDM4E
SCHEMBL26429213 0.83 CYP11B1 (0.36) ALDH1A1TDP1L3MBTL1CYP1A2CYP3A4
SCHEMBL8852754 0.83 ALDH1A1 (0.43) ALDH1A1TDP1L3MBTL1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10319912-B2 Charge-transporting material and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-06-11 — — US disclosed
US-20160225998-A1 CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225998-A1 CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225998-A1 CHARGE-TRANSPORTING MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-08-04 — — US disclosed
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