SCHEMBL9836295

SCHEMBL9836295

Cc1nn(C)c2[nH]c(=O)c3c(c12)CCN(C)C3

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 12/20 0.69
SHMT2 P34897 1/20 0.39
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
SCHEMBL4761629 0.82 PARP1 (1.00) PARP1
SCHEMBL5522439 0.82 PARP1 (1.00) PARP1
SCHEMBL9836935 0.81 PARP1 (0.97) PARP1
SCHEMBL5527862 0.70 PARP1 (0.68) PARP1
SCHEMBL4792310 0.69 PARP1 (0.56) PARP1
SCHEMBL4763087 0.68 PARP1 (0.63) PARP1
SCHEMBL4792007 0.67 PARP1 (0.57) PARP1
SCHEMBL2193298 0.66 PARP1 (0.54) PARP1
SCHEMBL5523765 0.65 PARP1 (0.59) PARP1
SCHEMBL4724958 0.65 PARP1 (0.63) PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0104522-B1 NEW PYRAZOLO(3,4-B)PYRIDINE DERIVATIVES AND PROCESS FOR PRODUCING THEM GRUPPO LEPETIT S.p.A. (IT) 1991-05-29 EP disclosed
US-4612318-A CNS-depressant and analgesic tricyclo-[pyrazolo-[3,4-6]-pyridine] derivatives and pharmaceutical compositions thereof GRUPPO LEPETIT S.P.A. (IT) 1986-09-16 US disclosed
EP-0104522-A2 New pyrazolo(3,4-b)pyridine derivatives and process for producing them GRUPPO LEPETIT S.p.A. (IT) 1984-04-04 EP disclosed