SCHEMBL20031997

SCHEMBL20031997

c1cn(C2CCCCCCCCC2)nn1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.37
EPHX2 P34913 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
CYP2B6 P20813 1/20 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
SCHEMBL20032245 1.00 EPHX1 (0.37) EPHX1EPHX2HCAR2CYP2B6
SCHEMBL20031998 1.00 EPHX1 (0.37) EPHX1EPHX2HCAR2CYP2B6
SCHEMBL5683395 1.00 EPHX1 (0.37) EPHX1EPHX2HCAR2CYP2B6
SCHEMBL17675657 0.98 EPHX1 (0.38) EPHX1EPHX2HCAR2
SCHEMBL23743045 0.93
SCHEMBL23697388 0.92 EPHX1 (0.34) EPHX1EPHX2HCAR2
Ammonia Solution, Strong SCHEMBL27350163 0.91 EPHX1 (0.37) EPHX1EPHX2HCAR2
SCHEMBL12984443 0.88
SCHEMBL14704905 0.81 HCAR2 (0.38) EPHX1EPHX2HCAR2
SCHEMBL2982280 0.80 EPHX1 (0.36) EPHX1EPHX2HCAR2

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-10245559-B2 Nanofiltration membranes and methods of use NOVOMER, INC. (US) 2019-04-02 US disclosed
US-20180094017-A1 OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE CONSTRUCT USING THE SAME, AND METHODS FOR PRODUCING THEM GIFU UNIVERSITY (JP) 2018-04-05 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-10245559-B2 Nanofiltration membranes and methods of use MLEC, EPCAM, LNPK EPHX1 584/4885EPHX2 723/4885HCAR2 4056/4885
US-20180094017-A1 OLIGONUCLEOTIDE DERIVATIVE, OLIGONUCLEOTIDE CONSTRUCT USING THE SAME, AND METHODS FOR PRODUCING THEM APOB, TTPA, AOX1 EPHX1 1258/4885EPHX2 1011/4885HCAR2 2825/4885

“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.