SCHEMBL9353585

SCHEMBL9353585

Cc1cc(C2(c3cc(C)c(Oc4ccc(N)cc4)c(C)c3)CCCC(C)C2)cc(C)c1Oc1ccc(N)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TEAD4 Q15561 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
ACHE P22303 1/20 0.31
MEN1 O00255 1/20 0.30
MITF O75030 1/20 0.30
GAA P10253 1/20 0.30
GFER P55789 1/20 0.30
KMT2A Q03164 1/20 0.30
NLRP1 Q9C000 1/20 0.30
NOD2 Q9HC29 1/20 0.30

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
SCHEMBL9349999 0.84 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9348458 0.84 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9349550 0.84 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9245298 0.84 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9353510 0.82 NFE2L2 (0.35) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9353491 0.81 NFE2L2 (0.34) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL9348695 0.80 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9348687 0.80 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9349932 0.80 ALDH1A1 (0.36) ALDH1A1SMN1; SMN2TEAD4TDP1MAPT
SCHEMBL9353666 0.80 CYP19A1 (0.34) ALDH1A1SMN1; SMN2L3MBTL1

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-0368604-B1 New diamino and dinitro compounds and a process for preparing the diamino compounds CHISSO CORP (JP) 1994-08-31 EP disclosed
US-5008456-A Chemical intermediates for polyamides and polyimides CHISSO CORPORATION (JP) 1991-04-16 US disclosed
EP-0368604-A2 New diamino and dinitro compounds and a process for preparing the diamino compounds CHISSO CORPORATION (JP) 1990-05-16 EP disclosed