SCHEMBL6780047

SCHEMBL6780047

Brc1cccc2c(C3CCNCC3)c[nH]c12

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.59
HTR2C P28335 8/20 0.58
ADRB2 P07550 1/20 0.58
IKBKB O14920 1/20 0.44
CHUK O15111 1/20 0.44
DYRK1A Q13627 1/20 0.44
APP P05067 2/20 0.41
HTR6 P50406 2/20 0.40
OPRM1 P35372 1/20 0.40
OPRK1 P41145 1/20 0.40
OPRL1 P41146 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
SCHEMBL21636393 0.90 SLC6A4 (0.69) SLC6A4HTR2CADRB2DYRK1AOPRM1
SCHEMBL21636296 0.87 SLC6A4 (0.62) SLC6A4HTR2CADRB2DYRK1AOPRM1
SCHEMBL6812169 0.83 HTR2C (0.59) SLC6A4HTR2CADRB2IKBKBCHUK
SCHEMBL653733 0.81 SLC6A4 (0.59) SLC6A4HTR2CADRB2IKBKBCHUK
SCHEMBL30832683 0.81 HTR2C (0.58) SLC6A4HTR2CADRB2IKBKBCHUK
SCHEMBL6782459 0.81 HTR2C (0.58) SLC6A4HTR2CADRB2IKBKBCHUK
Hydrochloric Acid SCHEMBL7866378 0.80 HTR2C (0.59) SLC6A4HTR2CADRB2IKBKBCHUK
SCHEMBL21624161 0.78 SLC6A4 (0.55) SLC6A4HTR2CADRB2DYRK1AOPRM1
SCHEMBL6087789 0.78 SLC6A4 (0.55) SLC6A4HTR2CADRB2IKBKBDYRK1A
SCHEMBL8723523 0.78 HTR2C (0.54) SLC6A4HTR2CADRB2IKBKBCHUK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183251-B1 INDOLYLPIPERIDINE DERIVATIVES AS ANTIHISTAMINIC AND ANTIALLERGIC AGENTS ALMIRALL PRODESFARMA SA (ES) 2004-02-11 EP disclosed
US-6683096-B2 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2004-01-27 US disclosed
US-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents ALMIRALL PRODESFARMA, S.A. (ES) 2002-10-10 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-20020147344-A1 Indolylpiperidine derivatives as antihistaminic and antiallergic agents HRH2, HRH1, HRH4 SLC6A4 445/4885HTR2C 32/4885ADRB2 31/4885

“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.