SCHEMBL16177992

SCHEMBL16177992

Nc1nc(N2CC3CC2CN3)c2ncsc2n1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.51
CHRNB2 P17787 1/20 0.44
CHRNA4 P43681 1/20 0.44
PI4KB Q9UBF8 2/20 0.42

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
SCHEMBL16178561 0.76 PI4KB (0.48) PI4KB
SCHEMBL16178451 0.72 PI4KB (0.52) PI4KB
SCHEMBL603773 0.71 HRH4 (0.54) HRH4CHRNB2CHRNA4
SCHEMBL603774 0.71 HRH4 (0.54) HRH4CHRNB2CHRNA4
SCHEMBL14948613 0.71 PI4KB (0.48) PI4KB
SCHEMBL3430563 0.71 HRH4 (0.54) HRH4CHRNB2CHRNA4
SCHEMBL16178464 0.71 PI4KB (0.48) PI4KB
SCHEMBL17993458 0.70 PI4KB (0.56) PI4KB
Hydrochloric Acid SCHEMBL16178577 0.70 PI4KB (0.47) PI4KB
SCHEMBL16178571 0.69 PI4KB (0.48) HRH4PI4KB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2776445-B1 THERAPEUTICALLY ACTIVE THIAZOLO-PYRIMIDINE DERIVATIVES UCB BIOPHARMA SPRL (BE) 2016-08-10 EP disclosed
US-9096614-B2 Therapeutically active thiazolo-pyrimidine derivatives UCB PHARMA SA (BE) 2015-08-04 US disclosed
US-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives UCB PHARMA SA (BE) 2014-10-23 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-20140315885-A1 Therapeutically Active Thiazolo-Pyrimidine Derivatives TPMT, IFNG, IRF3 HRH4 2766/4885CHRNB2 4410/4885CHRNA4 4475/4885

“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.