SCHEMBL218483

SCHEMBL218483

CCC(CC)Nc1nc(N)ncc1Cl

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.47
CRHR1 P34998 15/20 0.46
PIK3CD O00329 1/20 0.40
NUDT1 P36639 2/20 0.37
PDE1B Q01064 1/20 0.37

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
SCHEMBL9885019 0.85 BCL6 (0.46) BCL6PIK3CDNUDT1
SCHEMBL12692517 0.85 BCL6 (0.46) BCL6PIK3CDNUDT1
SCHEMBL15354459 0.85 BCL6 (0.46) BCL6PIK3CDNUDT1
SCHEMBL20652358 0.83 CRHR1 (0.48) CRHR1
SCHEMBL179496 0.81 BCL6 (0.43) BCL6CRHR1PIK3CDNUDT1
SCHEMBL179465 0.81 BCL6 (0.43) BCL6CRHR1PIK3CDNUDT1
SCHEMBL179450 0.81 BCL6 (0.43) BCL6CRHR1PIK3CDNUDT1
SCHEMBL12692509 0.81 NUDT1 (0.53) CRHR1NUDT1
SCHEMBL15354454 0.81 BCL6 (0.51) BCL6PIK3CDNUDT1
SCHEMBL217587 0.80 BCL6 (0.47) BCL6CRHR1NUDT1PDE1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8785470-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2014-07-22 US disclosed
WO-2014071105-A1 TREATMENT OF RHEUMATOID ARTHRITIS AND ASTHMA USING P13 KINASE INHIBITORS INFINITY PHARMACEUTICALS, INC. (US) 2014-05-08 WO disclosed
WO-2014071109-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS, INC. (US) 2014-05-08 WO disclosed
US-20120245169-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE LLC 2012-09-27 US disclosed
US-20120149701-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE, INC. 2012-06-14 US disclosed
US-8193182-B2 Substituted isoquinolin-1(2H)-ones, and methods of use thereof INTELLIKINE, INC. (US) 2012-06-05 US disclosed
US-20120059000-A1 CHEMICAL COMPOUNDS, COMPOSITIONS AND METHODS FOR KINASE MODULATION INFINITY PHARMACEUTICALS, INC. 2012-03-08 US disclosed
US-20090312319-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS INTELLIKINE 2009-12-17 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 (4 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-20090312319-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, PIK3CG, PIK3CB BCL6 3047/4885CRHR1 4755/4885PIK3CD 4/4885
US-20120059000-A1 CHEMICAL COMPOUNDS, COMPOSITIONS AND METHODS FOR KINASE MODULATION MAP3K13, AKT3, PIK3CA BCL6 1880/4885CRHR1 4487/4885PIK3CD 18/4885
US-20120245169-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, PIK3CG, PIK3CB BCL6 3047/4885CRHR1 4755/4885PIK3CD 4/4885
US-20120149701-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS PIK3CA, AKT3, PIK3C2A BCL6 3204/4885CRHR1 4793/4885PIK3CD 7/4885

“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.