SCHEMBL13043930

SCHEMBL13043930

CC(C)N1CCN(C(=O)CCN2CCOCC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.51
TSHR P16473 2/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GLA P06280 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.45
HTR1A P08908 1/20 0.43
HTR7 P34969 1/20 0.43
FKBP1A P62942 1/20 0.43
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL14453882 0.89 HRH3 (0.49) HRH3HSD17B10HTR1AHTR7LMNA
SCHEMBL7130414 0.87 HSD17B10 (0.64) TSHRALOX15HSD17B10GLASMN1; SMN2
SCHEMBL13419165 0.84 HRH3 (0.49) HRH3HTR1AHTR7POLBALDH1A1
SCHEMBL14471180 0.84 HRH3 (0.46) HRH3SMN1; SMN2HTR1AHTR7ALDH1A1
SCHEMBL13043899 0.84 HSD17B10 (0.73) HRH3TSHRALOX15HSD17B10LMNA
SCHEMBL7130429 0.83 GLA (0.62) TSHRALOX15HSD17B10GLASMN1; SMN2
SCHEMBL13043924 0.81 HRH3 (0.44) HRH3HSD17B10SMN1; SMN2HTR1AHTR7
SCHEMBL14627467 0.81 TSHR (0.53) TSHRALOX15HSD17B10GLASMN1; SMN2
SCHEMBL10092693 0.79 ALDH1A1 (0.50) HRH3GLASMN1; SMN2ALDH1A1
SCHEMBL26494077 0.79 HRH3 (0.42) HRH3HTR1AHTR7POLBALDH1A1

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-7829567-B2 Imino-indeno[1,2-c] quinoline derivatives, their preparation processes, and pharmaceutical compositions comprising the same KAOHSIUNG MEDICAL UNIVERSITY (TW) 2010-11-09 US disclosed
US-20090111987-A1 Imino-Indeno[1,2-c] quinoline derivatives, their preparation processes, and pharmaceutical compositions comprising the same KAOHSIUNG MEDICAL UNIVERSITY (TW) 2009-04-30 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-20090111987-A1 Imino-Indeno[1,2-c] quinoline derivatives, their preparation processes, and pharmaceutical compositions comprising the same IMPA1, IMPDH1, IPO5 HRH3 1002/4885TSHR 4307/4885ALOX15 4265/4885

“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.