SCHEMBL12380451

SCHEMBL12380451

Cc1n(C)cc[n+]1CC(=O)N1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
HPGD P15428 5/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 6/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TSHR P16473 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
Hydrochloric Acid SCHEMBL3845140 0.98 LMNA (0.48) LMNAHPGDPOLBALDH1A1GAA
Bromide SCHEMBL15258666 0.98 LMNA (0.51) LMNAHPGDPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL3844296 0.97 LMNA (0.50) LMNAHPGDPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL3850497 0.97 LMNA (0.50) LMNAHPGDPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL3846474 0.97 LMNA (0.50) LMNAHPGDPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL3849258 0.92 LMNA (0.46) LMNAHPGDPOLBALDH1A1GAA
Hydrochloric Acid SCHEMBL3847609 0.85 L3MBTL3 (0.45) ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL4114934 0.85 FKBP1A (0.42) LMNAHPGDPOLBALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL3847307 0.85 HPGD (0.38) LMNAHPGDALDH1A1HSD17B10
Hydrochloric Acid SCHEMBL3844460 0.84 CYP2D6 (0.45) LMNAHPGDPOLBALDH1A1GAA

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
US-8541598-B2 Biodegradable solvents for the chemical industry DUBLIN CITY UNIVERSITY (IE) 2013-09-24 US disclosed
US-8541598-B2 Biodegradable solvents for the chemical industry DUBLIN CITY UNIVERSITY (IE) 2013-09-24 US disclosed
US-20110201824-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY DUBLIN CITY UNIVERSITY (IE) 2011-08-18 US disclosed
US-20110201824-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY DUBLIN CITY UNIVERSITY (IE) 2011-08-18 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-20110201824-A1 BIODEGRADABLE SOLVENTS FOR THE CHEMICAL INDUSTRY TIMM9, B2M, TIMM44 LMNA 1911/4885HPGD 409/4885POLB 1552/4885

“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.