SCHEMBL4815397

SCHEMBL4815397

CN1CCN(Cc2ccc3c(c2)C(=O)CC3)CC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
HDAC6 Q9UBN7 1/20 0.48
MC4R P32245 1/20 0.47
ACHE P22303 1/20 0.47
HRH3 Q9Y5N1 3/20 0.47
CHKA P35790 5/20 0.47
KDR P35968 1/20 0.44
CA2 P00918 1/20 0.44
NCF1 P14598 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PARP1 P09874 1/20 0.44
PBRM1 Q86U86 1/20 0.44
HTR6 P50406 1/20 0.43
PIM1 P11309 1/20 0.43
CSNK1D P48730 1/20 0.43
ALDH1A1 P00352 1/20 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
SCHEMBL4814699 0.90 HRH3 (0.47) LMNAHDAC6ACHEHRH3CHKA
SCHEMBL4894879 0.90 ALDH1A1 (0.49) ACHEHRH3PBRM1HTR6ALDH1A1
SCHEMBL4821094 0.88 CHKA (0.49) LMNAHDAC6MC4RACHEHRH3
SCHEMBL4814489 0.88 HRH3 (0.56) ACHEHRH3PBRM1ALDH1A1
SCHEMBL4817712 0.86 HRH3 (0.53) HDAC6HRH3PARP1
SCHEMBL4807925 0.86 KDM4E (0.48) HRH3PARP1PBRM1ALDH1A1
SCHEMBL4818862 0.84 HRH3 (0.44) LMNAHRH3CHKAPBRM1ALDH1A1
SCHEMBL4817811 0.84 HRH3 (0.44) ACHEHRH3CHKAPBRM1HTR6
SCHEMBL4820190 0.84 KDM4E (0.48) HRH3PBRM1ALDH1A1
SCHEMBL4814854 0.84 CRBN (0.50) HRH3PBRM1HTR6

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 LMNA 3952/4885HDAC6 649/4885MC4R 3237/4885

“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.