SCHEMBL6833951

SCHEMBL6833951

O=C(O)N1CCC(CCn2c(-c3ccccc3)nc3c(S)nc4ccccc4c32)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.38
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TLR7 Q9NYK1 2/20 0.36
BRD4 O60885 4/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.35
CASR P41180 1/20 0.35
FAAH O00519 1/20 0.35
IDO1 P14902 1/20 0.35
HRH3 Q9Y5N1 4/20 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
SCHEMBL6928550 0.89 PTGER4 (0.40) PTGER4ALDH1A1TSHRSMN1; SMN2TLR7
SCHEMBL7489095 0.87 TRPV1 (0.38) PTGER4ALDH1A1TSHRSMN1; SMN2TLR7
SCHEMBL6834046 0.86 PTGER4 (0.36) PTGER4ALDH1A1TSHRSMN1; SMN2TLR7
SCHEMBL6929687 0.86 KDM4E (0.39) PTGER4ALDH1A1TSHRTLR7BRD4
SCHEMBL7489996 0.85 NPY1R (0.40) ALDH1A1TSHRSMN1; SMN2TLR7CASR
SCHEMBL6929280 0.84 KDM4E (0.43) ALDH1A1
SCHEMBL6930539 0.83 TLR7 (0.41) PTGER4ALDH1A1TSHRSMN1; SMN2TLR7
SCHEMBL6929719 0.80 PTGER4 (0.37) PTGER4BRD4IDO1HRH3
SCHEMBL6928754 0.80 CKS1B (0.38) PTGER4BRD4
SCHEMBL6838066 0.79 BRD4 (0.43) PTGER4TSHRBRD4HRH3

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-20040054182-A1 1h-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2004-03-18 US disclosed
EP-1256582-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-11-13 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-20040054182-A1 1h-imidazopyridine derivatives IL2, IL1A, IL4 PTGER4 1430/4885ALDH1A1 504/4885TSHR 1717/4885

“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.