SCHEMBL16471650

SCHEMBL16471650

COCCCn1nc(Br)c2c(C)cc(C(C)=O)cc21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 15/20 0.38
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL12525840 0.88 REN (0.47) RENNR3C1
SCHEMBL12525512 0.87 REN (0.38) RENKMT2AALDH1A1NR3C1CNR1
SCHEMBL15417952 0.87 ALDH1A1 (0.33) RENKMT2AALDH1A1NR3C1CNR1
SCHEMBL15417977 0.84 REN (0.40) RENCNR1CNR2
SCHEMBL12525523 0.79 REN (0.48) RENKMT2AALDH1A1NR3C1
SCHEMBL15417918 0.77 ESR1 (0.33) RENKMT2AALDH1A1NR3C1CNR1
SCHEMBL13132309 0.77 REN (0.37) RENALDH1A1NR3C1KDM4E
SCHEMBL13132282 0.77 REN (0.38) RENKMT2AALDH1A1NR3C1KDM4E
SCHEMBL15435679 0.75 REN (0.38) RENKMT2AALDH1A1NR3C1
SCHEMBL19512228 0.74 NR3C1 (0.33) RENKMT2AALDH1A1NR3C1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9278944-B2 Nitrogen-containing saturated heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-03-08 — — US disclosed
US-9278944-B2 Nitrogen-containing saturated heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-03-08 — — US disclosed
US-20140011807-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 2014-01-09 — — US disclosed
US-20140011807-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND SHANGHAI PHARMACEUTICALS HOLDING CO., LTD. (CN) 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-20140011807-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND REN, AGTR1, AGTR2 REN 1/4885KMT2A 721/4885ALDH1A1 2704/4885

“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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