SCHEMBL4818338

SCHEMBL4818338

CCc1nccn1Cc1ccc2c(c1)C(=O)CC2

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
WDR5 P61964 1/20 0.39
KCNH2 Q12809 6/20 0.39
ALDH1A1 P00352 2/20 0.39
ALPG P10696 2/20 0.38
PLAA Q9Y263 1/20 0.38
PBRM1 Q86U86 1/20 0.37
ALPL P05186 1/20 0.37
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
IL4I1 Q96RQ9 1/20 0.36
BRD4 O60885 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
SCHEMBL4815233 0.91 HSD17B1 (0.41) HTTMAPTRAB9AWDR5KCNH2
SCHEMBL4820188 0.85 LMNA (0.47) WDR5KCNH2PBRM1HRH3BRD4
SCHEMBL4812048 0.81 AGTR1 (0.43) HTTMAPTRAB9AKCNH2ALDH1A1
SCHEMBL4817613 0.81 GRM2 (0.43) WDR5KCNH2PBRM1AGTR2
SCHEMBL1512782 0.74 PBRM1 (0.53) MAPTRAB9AALDH1A1PBRM1GPR119
SCHEMBL4820438 0.74 GRM2 (0.43) WDR5KCNH2
SCHEMBL4811626 0.74 HTT (0.47) HTTMAPTRAB9AALDH1A1PBRM1
SCHEMBL4817612 0.73 PBRM1 (0.45) MAPTALDH1A1PBRM1HRH3IL4I1
SCHEMBL4813767 0.72 CYP19A1 (0.47) PBRM1HRH3IL4I1BRD4
SCHEMBL4819893 0.71 CYP17A1 (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
EP-1740579-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2007-01-10 EP disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 US disclosed
WO-2005095387-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-10-13 WO 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 HTT 4450/4885MAPT 2427/4885RAB9A 2541/4885

“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.