SCHEMBL1878809

SCHEMBL1878809

N#Cc1ccc2c(c1)c1c(n2Cc2ccccn2)CCC(NC(=O)C2CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.49
HTR6 P50406 1/20 0.49
PTGDR2 Q9Y5Y4 8/20 0.41
CNR1 P21554 1/20 0.38
EGFR P00533 1/20 0.37
IGF1R P08069 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
CNR2 P34972 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
USP30 Q70CQ3 1/20 0.36
KDM4E B2RXH2 1/20 0.36
POLB P06746 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL12637193 1.00 HRH1 (0.49) HRH1HTR6PTGDR2CNR1EGFR
SCHEMBL1884008 0.90 HRH1 (0.50) HRH1HTR6PTGDR2CNR1EGFR
SCHEMBL1884005 0.90 HRH1 (0.50) HRH1HTR6PTGDR2CNR1EGFR
SCHEMBL1876566 0.89 HRH1 (0.49) HRH1HTR6PTGDR2CNR1EGFR
SCHEMBL1876567 0.89 HRH1 (0.49) HRH1HTR6PTGDR2CNR1EGFR
SCHEMBL14624587 0.88 PTGDR2 (0.42) PTGDR2CNR1EGFRIGF1RFLT4
SCHEMBL12637190 0.87 PTGDR2 (0.41) HRH1HTR6PTGDR2
SCHEMBL1880800 0.87 PTGDR2 (0.41) HRH1HTR6PTGDR2
SCHEMBL12637212 0.86 PTGDR2 (0.41) PTGDR2CNR1EGFRIGF1RFLT4
SCHEMBL28633114 0.85 HRH1 (0.47) HRH1HTR6PTGDR2CNR1CNR2

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-7935722-B2 Tetrahydrocarbazole derivatives useful as androgen receptor modulators ELI LILLY AND COMPANY (US) 2011-05-03 US disclosed
US-20100022550-A1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS CELLECTIS (FR) 2010-01-28 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-20100022550-A1 TETRAHYDROCARBAZOLE DERIVATIVES USEFUL AS ANDROGEN RECEPTOR MODULATORS AR, SHBG, CYP17A1 HRH1 1601/4885HTR6 2621/4885PTGDR2 437/4885

“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.