SCHEMBL3139980

SCHEMBL3139980

c1cnc2c(c1)C1NCC[C@@H]1C2

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.37
HTR1A P08908 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 1/20 0.36
CYP19A1 P11511 1/20 0.35
CHRNB2 P17787 2/20 0.35
CHRNA4 P43681 2/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA2 Q15822 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35

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
SCHEMBL3133189 1.00 PRCP (0.37) PRCPHTR1ASLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL52335 0.98 PRCP (0.36) PRCPHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL11072585 0.85 PRCP (0.43) PRCPHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL3869434 0.85 PRCP (0.43) PRCPHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL31569538 0.80 PRCP (0.47) PRCPHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL9600234 0.72 PRCP (0.57) PRCPCHRNB2CHRNA4
SCHEMBL31374588 0.72 PRCP (0.57) PRCPCHRNB2CHRNA4
SCHEMBL31374586 0.72 PRCP (0.57) PRCPCHRNB2CHRNA4
SCHEMBL25732308 0.69 CYP19A1 (0.36) SLC6A4CYP19A1DRD2DRD1
SCHEMBL10152945 0.67 HTR1A (0.42) HTR1ASLC6A2SLC6A4SLC6A3CYP19A1

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-20100076011-A1 Enantiomer-Pure Hexahydro-Pyrrolocyclopenta-Pyridine Derivatives BINDER, EVA (AT) 2010-03-25 US disclosed
EP-1740585-B1 ENANTIOMER-PURE HEXAHYDROPYRROLOCYCLOPENTAPYRIDINE DERIVATIVES BINDER EVA (AT) 2009-08-19 EP 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-20100076011-A1 Enantiomer-Pure Hexahydro-Pyrrolocyclopenta-Pyridine Derivatives FFAR3, FFAR2, FFAR1 PRCP 2159/4885HTR1A 361/4885SLC6A2 2669/4885

“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.