SCHEMBL16178789

SCHEMBL16178789

COc1ccc(NC(=O)N2CCNC(C)C2)c(Cl)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NTRK1 P04629 4/20 0.41
▸ PI4KB Q9UBF8 2/20 0.41
▸ MAPT P10636 4/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HRH4 Q9H3N8 1/20 0.38
▸ TP53 P04637 3/20 0.37
▸ MDM2 Q00987 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.37
▸ LMNA P02545 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ SHMT2 P34897 1/20 0.36
▸ SCN9A Q15858 2/20 0.35
▸ PAK4 O96013 2/20 0.35
▸ SCN10A Q9Y5Y9 1/20 0.35
▸ MAPK1 P28482 1/20 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
SCHEMBL16178749 0.88 MAPK1 (0.43) NTRK1PI4KBMAPTSMN1; SMN2HRH4
SCHEMBL16178736 0.88 PI4KB (0.51) NTRK1PI4KBMAPTHRH4SCN9A
SCHEMBL16178784 0.79 HRH4 (0.38) NTRK1MAPTHRH4TP53MDM2
SCHEMBL16178781 0.79 SMN1; SMN2 (0.48) NTRK1MAPTSMN1; SMN2L3MBTL1TP53
SCHEMBL16178773 0.76 PI4KB (0.48) NTRK1PI4KBSCN9ASCN10A
SCHEMBL16178733 0.75 PKM (0.64) MAPTSMN1; SMN2L3MBTL1TP53LMNA
SCHEMBL16178776 0.75 NTRK1 (0.41) NTRK1PI4KBSMN1; SMN2L3MBTL1HRH4
SCHEMBL16177994 0.75 PI4KB (0.50) PI4KBMAPTALDH1A1POLB
SCHEMBL16178762 0.74 SMN1; SMN2 (0.54) NTRK1MAPTSMN1; SMN2L3MBTL1TP53
SCHEMBL16178743 0.74 REN (0.38) NTRK1HRH4SCN9APAK4SCN10A

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-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 NTRK1 3223/4885PI4KB 800/4885MAPT 2357/4885

“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.

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