SCHEMBL17811534

SCHEMBL17811534

C=C(c1ccc(N(CC)CC)cc1)c1cccc(C(=C)c2ccc(N(CC)CC)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
CYP3A4 P08684 2/20 0.50
MAPT P10636 6/20 0.47
MAPK1 P28482 3/20 0.47
NOX1 Q9Y5S8 3/20 0.47
TSHR P16473 2/20 0.47
MCL1 Q07820 2/20 0.47
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.47
PKM P14618 1/20 0.47
TDP1 Q9NUW8 2/20 0.43
HDAC6 Q9UBN7 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 1/20 0.43
GFER P55789 2/20 0.42
PSMD14 O00487 1/20 0.42
RECQL P46063 1/20 0.42
POLB P06746 2/20 0.41

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
SCHEMBL17811467 0.92 MEN1 (0.47) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL609137 0.89 MEN1 (0.63) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL1458445 0.89 ALDH1A1 (0.52) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL609060 0.84 ALDH1A1 (0.58) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL10603474 0.81 MEN1 (0.63) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL17811466 0.79 MEN1 (0.78) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL20306694 0.79 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL14174046 0.78 TSHR (0.51) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL30100935 0.77 ALDH1A1 (0.41) ALDH1A1MEN1KMT2ACYP3A4MAPT
SCHEMBL9502935 0.77 MAPT (0.49) ALDH1A1MEN1KMT2ACYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005869-B2 Polymerisation initiators TRINSEO EUROPE GMBH (CH) 2018-06-26 US disclosed
US-10005869-B2 Polymerisation initiators TRINSEO EUROPE GMBH (CH) 2018-06-26 US disclosed
EP-3024855-B1 POLYMERISATION INITIATORS TRINSEO EUROPE GMBH (CH) 2017-05-31 EP disclosed
US-20160159956-A1 Polymerisation Initiators TRINSEO EUROPE GMBH (CH) 2016-06-09 US disclosed
US-20160159956-A1 Polymerisation Initiators TRINSEO EUROPE GMBH (CH) 2016-06-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10005869-B2 Polymerisation initiators ELOVL5, ELOVL3, ELOVL1 ALDH1A1 3863/4885MEN1 3319/4885KMT2A 2066/4885
US-20160159956-A1 Polymerisation Initiators ELOVL5, ELOVL3, ELOVL1 ALDH1A1 3863/4885MEN1 3319/4885KMT2A 2066/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.