SCHEMBL2436751

SCHEMBL2436751

c1ccc2c(c1)CCC2C1NCC12CCNCC2

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.39
SRD5A1 P18405 3/20 0.37
DRD1 P21728 1/20 0.36
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
GAA P10253 1/20 0.36
HTR2B P41595 1/20 0.36
SIGMAR1 Q99720 1/20 0.35
ADRA1A P35348 1/20 0.35
IDO1 P14902 1/20 0.34

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
SCHEMBL2438617 0.76 HTR2A (0.41) PRCPSRD5A1HTR2AHTR2CHTR2B
SCHEMBL30584392 0.76 TSHR (0.42) SRD5A1SIGMAR1
SCHEMBL5871094 0.72 SIGMAR1 (0.49) PRCPSRD5A1HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL6251671 0.70 SIGMAR1 (0.50) SRD5A1HTR2CSIGMAR1IDO1
SCHEMBL11671198 0.70 SRD5A1 (0.55) SRD5A1HTR2ASIGMAR1IDO1
Magnesium SCHEMBL31510119 0.68 SRD5A1 (0.53) SRD5A1HTR2ASIGMAR1IDO1
SCHEMBL1912706 0.68 HTR2C (0.53) PRCPHTR2AHTR2CGAAHTR2B
SCHEMBL30613544 0.67 HTR2C (0.46) PRCPSRD5A1DRD1HTR2AHTR2C
SCHEMBL6188502 0.67 HTR2C (0.46) PRCPSRD5A1DRD1HTR2AHTR2C
SCHEMBL22260050 0.66 DRD2 (0.51) PRCPSRD5A1DRD1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2547679-B1 2,3 DIHYDRO-1H-INDEN-1-YL-2,7-DIAZASPIRO[3.6]NONANE DERIVATIVES AND THEIR USE AS ANTAGONISTS OR INVERSE AGONISTS OF THE GHRELIN RECEPTOR PFIZER (US) 2015-11-04 EP disclosed
US-20140080756-A1 2,3-DIHYDRO-1H-INDEN-1-YL-2,7-DIAZASPIRO[3.5]NONANE DERIVATIVES PFIZER INC. (US) 2014-03-20 US disclosed
US-8609680-B2 2,3-dihydro-1H-inden-1-yl-2,7-diazaspiro[3.5] nonane derivatives PFIZER INC. (US) 2013-12-17 US disclosed
EP-2547679-A1 2,3 DIHYDRO-1H-INDEN-1-YL- 2,7-DIAZASPIRO [3.6]NONANE DERIVATIVES AND THEIR USE AS ANTAGONISTS OR INVERSE AGONISTS OF THE GHRELIN RECEPTOR Pfizer Inc. (US) 2013-01-23 EP disclosed
WO-2011114271-A1 2,3 DIHYDRO-1H-INDEN-1-YL- 2,7-DIAZASPIRO [3.6] NONANE DERIVATIVES AND THEIR USE AS ANTAGONISTS OR INVERSE AGONISTS OF THE GHRELIN RECEPTOR PFIZER INC. (US) 2011-09-22 WO disclosed
US-20110230461-A1 2,3-DIHYDRO-1H-INDEN-1-YL-2,7-DIAZASPIRO[3.5] NONANE DERIVATIVES PFIZER INC. 2011-09-22 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 (2 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-20140080756-A1 2,3-DIHYDRO-1H-INDEN-1-YL-2,7-DIAZASPIRO[3.5]NONANE DERIVATIVES GIPR, GLP1R, GHSR PRCP 2020/4885SRD5A1 963/4885DRD1 723/4885
US-20110230461-A1 2,3-DIHYDRO-1H-INDEN-1-YL-2,7-DIAZASPIRO[3.5] NONANE DERIVATIVES GIPR, GLP1R, GHSR PRCP 2078/4885SRD5A1 947/4885DRD1 630/4885

“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.