SCHEMBL3310229

SCHEMBL3310229

CCN(C(=O)S)c1nc2c(s1)C(=O)C(C(=O)c1cncnc1)CC2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.31

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
SCHEMBL3310236 0.89 ALDH1A1 (0.31) ALDH1A1
SCHEMBL3308142 0.88 HTT (0.39) ALDH1A1
SCHEMBL3279143 0.75 ALDH1A1 (0.37) ALDH1A1
SCHEMBL3273615 0.73 LMNA (0.39) ALDH1A1
SCHEMBL10103045 0.73 ALDH1A1 (0.34) ALDH1A1
SCHEMBL3279154 0.70 ALDH1A1 (0.38) ALDH1A1
SCHEMBL3309734 0.69 KDM4E (0.40) ALDH1A1
SCHEMBL3277195 0.64 ALDH1A1 (0.47) ALDH1A1
SCHEMBL10103042 0.62 RAB9A (0.42) ALDH1A1
SCHEMBL798617 0.62 PIK3CG (0.49) ALDH1A1

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-8207349-B2 Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-26 US disclosed
US-20100113414-A1 THIAZOLYL-DIHYDRO-INDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-05-06 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-20100113414-A1 THIAZOLYL-DIHYDRO-INDAZOLES MKI67, CYP11B1, IGF1R ALDH1A1 41/4885

“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.