SCHEMBL16458982

SCHEMBL16458982

CC1=CCC(C(c2ccccc2)c2ccccc2)=C1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 3/20 0.34
SLC6A4 P31645 3/20 0.34
SLC6A3 Q01959 3/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.32
CFTR P13569 1/20 0.31
GOPC Q9HD26 1/20 0.31
DPP4 P27487 2/20 0.30
F2 P00734 1/20 0.30
TSHR P16473 1/20 0.30
ACP3 P15309 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
SCHEMBL12815416 0.82 ACHE (0.37) GAAACP3
SCHEMBL12815183 0.77 CYP2D6 (0.34) SLC6A2SLC6A4SLC6A3GAACYP2D6
SCHEMBL12815424 0.76
SCHEMBL12814616 0.76 LMNA (0.34) SLC6A2SLC6A4SLC6A3GAACYP2D6
SCHEMBL12815009 0.76 CYP1A2 (0.33) SLC6A2SLC6A4SLC6A3TSHR
SCHEMBL12815411 0.74 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3GAACFTR
SCHEMBL12816039 0.72 TSHR (0.37) SLC6A2SLC6A4SLC6A3CYP2D6TSHR
SCHEMBL12814587 0.71 OPRL1 (0.36) GAADPP4
SCHEMBL12814742 0.71 CALM1 (0.37) SLC6A2SLC6A4SLC6A3CYP2D6TSHR
SCHEMBL7199931 0.69

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-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-01-09 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 (1 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-20140012056-A1 METHOD FOR PRODUCING 1-HEXENE AP2A1, AP1M1, ME1 SLC6A2 4749/4885SLC6A4 4714/4885SLC6A3 4766/4885

“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.