SCHEMBL14277972

SCHEMBL14277972

Ic1cccc(N(c2ccccc2)c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ APP P05067 2/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ CRHBP P24387 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35
▸ MGLL Q99685 2/20 0.34

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
SCHEMBL12922776 0.98 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL31354848 0.90 ALDH1A1 (0.44) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL15750399 0.90 ALDH1A1 (0.44) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL15088351 0.88 HSD17B1 (0.39) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL25615342 0.86 ALDH1A1 (0.50) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL6951689 0.86 ALDH1A1 (0.50) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL16865880 0.86 ALDH1A1 (0.50) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL20059526 0.85 ALDH1A1 (0.42) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL23108823 0.84 ALDH1A1 (0.48) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4
SCHEMBL18680560 0.84 ALDH1A1 (0.48) ALDH1A1L3MBTL1KDM4ECYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1898262-A1 Electrophotographic photoconductor and method for producing the same, image forming apparatus, and process cartridge Ricoh Company, Ltd. (JP) 2008-03-12 — — EP disclosed
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