SCHEMBL9313469

SCHEMBL9313469

C=CC(=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1)C1(c2ccc(OC)cc2OC)OC(=O)c2cc(N(C)C)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CYP3A4 P08684 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
TSHR P16473 1/20 0.42
CYP2C19 P33261 1/20 0.42
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
HPGD P15428 1/20 0.41
HIF1A Q16665 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAOB P27338 6/20 0.37
MAOA P21397 4/20 0.37
MAPT P10636 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
USP2 O75604 1/20 0.37
MAPK1 P28482 1/20 0.37
TLR9 Q9NR96 1/20 0.37
PRKCA P17252 2/20 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
SCHEMBL9313241 0.89 CYP3A4 (0.47) MEN1KMT2ACYP3A4LMNACYP1A2
SCHEMBL9312454 0.89 CYP3A4 (0.47) MEN1KMT2ACYP3A4LMNACYP1A2
SCHEMBL9314487 0.85 CYP3A4 (0.46) MEN1KMT2ACYP3A4LMNACYP1A2
SCHEMBL9313090 0.83 ALDH1A1 (0.42) MEN1KMT2ACYP3A4LMNACYP1A2
SCHEMBL9313962 0.82 ALDH1A1 (0.41) MEN1KMT2ACYP3A4ALDH1A1TDP1
SCHEMBL9314735 0.81 ALDH1A1 (0.49) MEN1KMT2ACYP3A4LMNACYP1A2
SCHEMBL9313965 0.81 ALDH1A1 (0.45) MEN1KMT2ACYP3A4TSHRALDH1A1
SCHEMBL9313534 0.80 ALDH1A1 (0.39) MEN1KMT2ACYP3A4LMNAALDH1A1
SCHEMBL9313095 0.79 ALDH1A1 (0.46) MEN1KMT2ACYP3A4LMNATSHR
SCHEMBL9312528 0.79 ALDH1A1 (0.49) MEN1KMT2ACYP3A4LMNAALDH1A1

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
US-5286702-A Color coupler for infrared recording YAMADA CHEMICAL CO., LTD. (JP) 1994-02-15 US disclosed