SCHEMBL20045003

SCHEMBL20045003

C(=C/c1c2cc3ccccc3cc2c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cc3ccccc3cc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RELA Q04206 3/20 0.47
▸ APP P05067 3/20 0.43
▸ MAPT P10636 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ RXFP1 Q9HBX9 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ CTNNB1 P35222 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ PDGFRB P09619 1/20 0.38

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
SCHEMBL30799903 0.88 APP (0.46) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL13897114 0.88 APP (0.46) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL19138026 0.85 APP (0.51) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL26153346 0.85 APP (0.51) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL12315190 0.85 APP (0.51) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL13480603 0.85 APP (0.51) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL17125500 0.84 APP (0.43) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL13897126 0.84 RELA (0.52) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL2452480 0.84 APP (0.43) RELAAPPMAPTALDH1A1L3MBTL1
SCHEMBL9971800 0.83 APP (0.45) RELAAPPMAPTALDH1A1L3MBTL1

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-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 — — US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 — — US disclosed
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