SCHEMBL14906941

SCHEMBL14906941

C/C=C\N=c1\c(-c2cc(OC)c(OC)cc2Cc2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc2cc(OC)c(OC)cc2n1C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SRD5A1 P18405 1/20 0.36
▸ SRD5A2 P31213 1/20 0.36
▸ MTNR1A P48039 1/20 0.31
▸ MTNR1B P49286 1/20 0.31
▸ ACHE P22303 2/20 0.31
▸ RET P07949 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
SCHEMBL16994469 0.72 PTAFR (0.38) SRD5A1SRD5A2MTNR1AMTNR1BACHE
SCHEMBL14930622 0.67 CTDSP1 (0.36) ACHERET
SCHEMBL16994470 0.64 PDGFRB (0.40) ACHE
SCHEMBL14903985 0.62 MTNR1A (0.33) MTNR1AMTNR1B
SCHEMBL12074762 0.57 PDE10A (0.43) ACHE
SCHEMBL12075017 0.56 PDGFRB (0.67) —
SCHEMBL14906990 0.56 MTNR1A (0.42) MTNR1AMTNR1BACHE
SCHEMBL12074886 0.56 SLC2A1 (0.57) —
SCHEMBL1542350 0.55 ALDH1A1 (0.50) —
SCHEMBL19683672 0.54 PGR (0.60) —

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-20130109713-A1 ANTIMICROBIAL AGENTS UNIVERSITY OF MEDICINE AND DENTISTRY OF NEW JERSEY 2013-05-02 — — 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-20130109713-A1 ANTIMICROBIAL AGENTS RPS4X, RPS4Y1, MRPL21 SRD5A1 2052/4885SRD5A2 2919/4885MTNR1A 1533/4885

“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.

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