SCHEMBL9165801

SCHEMBL9165801

CC(C)Oc1cc(OC(C)C)cc(N(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2cc(OC(C)C)cc(OC(C)C)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ CNR2 P34972 1/20 0.37
▸ CETP P11597 1/20 0.37
▸ FGFR1 P11362 1/20 0.36
▸ KMT2A Q03164 4/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ TLR9 Q9NR96 1/20 0.35
▸ RXRA P19793 1/20 0.35

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
SCHEMBL9280337 0.95 RXRA (0.42) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL9277735 0.87 RXRA (0.39) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL10047611 0.86 KMT2A (0.47) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL13339055 0.80 PPARG (0.40) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL14466536 0.78 NPC1 (0.46) ALDH1A1KDM4ECYP3A4MAPTCYP1A2
SCHEMBL12964972 0.76 TSHR (0.49) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL8944025 0.75 L3MBTL1 (0.45) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL9163960 0.74 ABL1 (0.46) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL9156600 0.74 ALDH1A1 (0.41) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT
SCHEMBL8766581 0.72 CA4 (0.48) ALDH1A1L3MBTL1KDM4ECYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0314195-B1 Electrophotographic sensitive material MITA INDUSTRIAL CO LTD (JP) 1995-03-22 — — EP disclosed
US-4877702-A PERYLENE TYPE ELECTRIC CHARGE GENERATING SUBSTANCE AND DIAMINE DERIVATIVE AS ELECTRIC CHARGE TRANSFERRING SUBSTANCE MITA INDUSTRIAL CO., LTD. (JP) 1989-10-31 — — US disclosed
EP-0314195-A2 Electrophotographic sensitive material MITA INDUSTRIAL CO. LTD. (JP) 1989-05-03 — — EP disclosed
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