SCHEMBL17811469

SCHEMBL17811469

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.48
HPGD P15428 3/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
NPC1 O15118 2/20 0.48
ALDH1A1 P00352 7/20 0.46
GFER P55789 1/20 0.46
MAPT P10636 5/20 0.45
KCNK3 O14649 2/20 0.45
TSHR P16473 3/20 0.44
ALOX15 P16050 2/20 0.44
MAPK1 P28482 2/20 0.44
CYP3A4 P08684 1/20 0.44
HBB P68871 1/20 0.44
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
ALPG P10696 1/20 0.41
ATM Q13315 1/20 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
SCHEMBL6937372 0.88 ALDH1A1 (0.56) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL17811477 0.82 RAB9A (0.33) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL20306696 0.80 ALDH1A1 (0.46) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL17811470 0.77 ALDH1A1 (0.41) RAB9AKMT2AMEN1NPC1ALDH1A1
SCHEMBL17815536 0.77
SCHEMBL8153005 0.76 RAB9A (0.62) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL8153001 0.76 RAB9A (0.62) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL8184701 0.76 RAB9A (0.62) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL10473229 0.76 MAOB (0.56) RAB9AHPGDKMT2AMEN1NPC1
SCHEMBL10473228 0.76 MAOB (0.56) RAB9AHPGDKMT2AMEN1NPC1

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
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
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 RAB9A 4875/4885HPGD 1418/4885KMT2A 2066/4885
US-20160159956-A1 Polymerisation Initiators ELOVL5, ELOVL3, ELOVL1 RAB9A 4875/4885HPGD 1418/4885KMT2A 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.