SCHEMBL8540270

SCHEMBL8540270

Cc1cccc(C2CC(C)CC(C(C)C)C2)c1Oc1ccc(N)cc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
TEAD4 Q15561 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
MAPT P10636 2/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 1/20 0.31
MITF O75030 1/20 0.31
GAA P10253 1/20 0.31
GFER P55789 1/20 0.31
KMT2A Q03164 1/20 0.31
NLRP1 Q9C000 1/20 0.31
NOD2 Q9HC29 1/20 0.31
TNK2 Q07912 2/20 0.31

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
SCHEMBL8540276 0.76 ALDH1A1 (0.35) ALDH1A1
SCHEMBL8972686 0.72
SCHEMBL16659204 0.70 TEAD4 (0.56) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL8972693 0.66 ALDH1A1 (0.32) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL28308046 0.65 SLC6A2 (0.54)
SCHEMBL11138432 0.62 ALDH1A1 (0.55) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL10816306 0.61 ALDH1A1 (0.45) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL8694523 0.61 OPRM1 (0.37) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL24812531 0.61 MAOA (0.39) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB
SCHEMBL8694525 0.60 ALDH1A1 (0.36) ALDH1A1TEAD4SMN1; SMN2MAPTPOLB

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-5734008-A AROMATIC ETHERDIAMINES FOR POLYIMIDE FILMS FOR PRINTED CIRCUITS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-03-31 US disclosed