SCHEMBL17815538

SCHEMBL17815538

C=C(c1ccc(SCC)cc1)c1cccc(C(=C)c2ccc(SCC)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.40
MAOA P21397 1/20 0.40
RAB9A P51151 2/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
GFER P55789 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GPR55 Q9Y2T6 1/20 0.34
TP53 P04637 1/20 0.34
PTGS2 P35354 1/20 0.33

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
SCHEMBL17811484 0.94 SLC6A4 (0.36) SLC6A4MAOARAB9AGAAMEN1
SCHEMBL17811535 0.83 MAOA (0.45) MAOARAB9AKMT2ANPC1MAPT
SCHEMBL17811483 0.79 MEN1 (0.41) SLC6A4RAB9AGAAMEN1KMT2A
SCHEMBL17815471 0.79 SLC6A4 (0.38) SLC6A4MAOARAB9AGAANPC1
SCHEMBL17811489 0.79 MAOA (0.41) MAOARAB9AKMT2ANPC1TAS1R3
SCHEMBL18902814 0.78 MAOA (0.40) MAOARAB9AKMT2ANPC1MAPT
SCHEMBL17815539 0.77 SLC6A4 (0.39) SLC6A4MAOARAB9AGAANPC1
SCHEMBL2750566 0.76 ALDH1A1 (0.45) MEN1KMT2ATAS1R3TAS1R1MAPT
SCHEMBL17811487 0.74 SLC6A4 (0.34) SLC6A4MAOARAB9AGAANPC1
SCHEMBL21321932 0.73 SLC6A4 (0.44) SLC6A4MAOARAB9AGAANPC1

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 2 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-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 SLC6A4 4512/4885MAOA 1229/4885RAB9A 4875/4885
US-20160159956-A1 Polymerisation Initiators ELOVL5, ELOVL3, ELOVL1 SLC6A4 4512/4885MAOA 1229/4885RAB9A 4875/4885

“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.