SCHEMBL6215184

SCHEMBL6215184

CSc1nc(-c2ccccc2)c2c(N)c(C(=O)NCC34CC5CC(CC(C5)C3)C4)sc2n1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ LHCGR P22888 8/20 0.51
▸ TSHR P16473 2/20 0.50
▸ FSHR P23945 1/20 0.46
▸ P2RX7 Q99572 3/20 0.44
▸ CHRM4 P08173 2/20 0.43
▸ CNR1 P21554 1/20 0.42
▸ TP53 P04637 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL6217958 0.82 CHRM4 (0.60) LHCGRTSHRFSHRCHRM4ALDH1A1
SCHEMBL6217802 0.80 LHCGR (0.58) LHCGRTSHRFSHRCHRM4KDM4E
SCHEMBL6220425 0.79 LHCGR (0.55) LHCGRTSHRFSHRCHRM4CNR1
SCHEMBL6215311 0.78 LHCGR (0.61) LHCGRTSHRFSHRKDM4EALDH1A1
SCHEMBL6216183 0.78 LHCGR (0.54) LHCGRTSHRFSHRCHRM4KDM4E
SCHEMBL6216455 0.78 LHCGR (0.59) LHCGRTSHRFSHRKDM4EALDH1A1
SCHEMBL6217403 0.77 LHCGR (0.60) LHCGRTSHRFSHRCHRM4KDM4E
SCHEMBL6216753 0.77 LHCGR (0.55) LHCGRTSHRFSHRCHRM4CNR1
SCHEMBL6217357 0.77 LHCGR (0.55) LHCGRTSHRFSHRCHRM4
SCHEMBL6214860 0.77 LHCGR (0.56) LHCGRTSHRFSHRCHRM4KDM4E

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
EP-1171443-B1 BICYCLIC HETEROAROMATIC COMPOUNDS USEFUL AS LH AGONISTS AKZO NOBEL NV (NL) 2005-07-13 — — EP disclosed
US-6841553-B2 Bicyclic heteroaromatic compounds useful as LH agonists AKZO NOBEL N.V. (NL) 2005-01-11 — — US disclosed
US-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists MERCK SHARP & DOHME B.V. (NL) 2003-11-13 — — US disclosed
US-6569863-B1 Luteinizing hormone (LH) agonists for controlling fertility AKZO NOBEL NV (NL) 2003-05-27 — — 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-20030212081-A1 Bicyclic heteroaromatic compounds useful as LH agonists LHCGR, GNRHR, FSHR LHCGR 1/4885TSHR 176/4885FSHR 3/4885

“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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