SCHEMBL13239146

SCHEMBL13239146

CCC1CCN(CCC(=O)O)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.48
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
KDM1A O60341 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CYP1A2 P05177 1/20 0.41
MAPK1 P28482 1/20 0.41
GSK3B P49841 1/20 0.37
S1PR1 P21453 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
APEX1 P27695 1/20 0.37
HTR4 Q13639 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
SCHEMBL17988092 0.85 GLA (0.46) GLAPOLBHTTKDM1ASMN1; SMN2
SCHEMBL15818845 0.82 GLA (0.50) GLAPOLBHTTKDM1ASMN1; SMN2
SCHEMBL11155988 0.82 GLA (0.50) GLAPOLBHTTKDM1ASMN1; SMN2
Acetic Acid SCHEMBL30331117 0.81 SMN1; SMN2 (0.46) SMN1; SMN2HTR4
SCHEMBL21472144 0.81 GLA (0.48) GLAPOLBHTTKDM1ASMN1; SMN2
SCHEMBL21026033 0.80 GLA (0.44) GLAPOLBHTTKDM1ASMN1; SMN2
SCHEMBL25111010 0.80 POLB (0.39) POLBHTTSMN1; SMN2
SCHEMBL14609741 0.80 SMN1; SMN2 (0.64) POLBHTTKDM1ASMN1; SMN2
SCHEMBL6866270 0.80 POLB (0.39) POLBHTTSMN1; SMN2
SCHEMBL14609561 0.80 HSD17B10 (0.45) SMN1; SMN2GSK3BS1PR1

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
WO-2019101188-A1 NOVEL BENZOIMIDAZOLES AS SELECTIVE INHIBITORS OF INDOLEAMINE 2, 3-DIOXYGENASES BEIGENE, LTD. (GB) 2019-05-31 WO disclosed
EP-3250552-B1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH INC (US) 2019-03-27 EP disclosed
WO-2016123387-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-08-04 WO disclosed
US-20100216763-A1 Heteroaryl Amide Derivatives H. LUNDBECK A/S (DK) 2010-08-26 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-20100216763-A1 Heteroaryl Amide Derivatives HCAR2, PIGS, GPR52 GLA 1825/4885POLB 4088/4885HTT 1498/4885

“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.