SCHEMBL7477607

SCHEMBL7477607

Cc1ccccc1Cn1cc2c(=O)[nH]cnc2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HSD17B10 Q99714 2/20 0.39
KDM4A O75164 1/20 0.39
LMNA P02545 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CHRNE Q04844 1/20 0.38
PDPK1 O15530 1/20 0.38
CA12 O43570 1/20 0.38
ALOX15 P16050 1/20 0.38
CA9 Q16790 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
IP6K1 Q92551 1/20 0.38
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 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
SCHEMBL7478856 0.86 IP6K1 (0.41) PARP1SMN1; SMN2MEN1KMT2AHSD17B10
SCHEMBL7472669 0.85 PARP1 (0.43) PARP1SMN1; SMN2MEN1KMT2APDPK1
SCHEMBL7482606 0.85 MEN1 (0.56) PARP1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7473258 0.85 TYR (0.40) PARP1SMN1; SMN2MEN1KMT2AHSD17B10
SCHEMBL7482908 0.81 PARP1 (0.47) PARP1SMN1; SMN2MEN1KMT2APDPK1
SCHEMBL7479263 0.81 MAPT (0.52) PARP1SMN1; SMN2HSD17B10PDPK1CA12
SCHEMBL7519908 0.80 AR (0.42) SMN1; SMN2MEN1KMT2AHSD17B10KDM4A
SCHEMBL7478583 0.75 PARP1 (0.48) PARP1SMN1; SMN2MEN1KMT2AHSD17B10
SCHEMBL7483064 0.75 PARP1 (0.48) PARP1SMN1; SMN2MEN1KMT2AHSD17B10
SCHEMBL7478020 0.75 ALDH1A1 (0.45) PARP1SMN1; SMN2MEN1KMT2ALMNA

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-1005471-B1 PYRAZOLO(3,4-D)PYRIMIDINES WITH ANTICONVULSIVE AND ANTIALLERGIC/ANTIASTHMATIC ACTION DRESDEN ARZNEIMITTEL (DE) 2002-09-04 EP claimed
EP-1005471-A1 PYRAZOLO(3,4-D)PYRIMIDINES WITH ANTICONVULSIVE AND ANTIALLERGIC/ANTIASTHMATIC ACTION ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-06-07 EP claimed
WO-1999067243-A1 PYRAZOLO(3,4-D)PYRIMIDINES WITH ANTICONVULSIVE AND ANTIALLERGIC/ANTIASTHMATIC ACTION ARZNEIMITTELWERK DRESDEN GMBH (DE) 1999-12-29 WO claimed
EP-1005471-B1 PYRAZOLO(3,4-D)PYRIMIDINES WITH ANTICONVULSIVE AND ANTIALLERGIC/ANTIASTHMATIC ACTION DRESDEN ARZNEIMITTEL (DE) 2002-09-04 EP disclosed
US-6054460-A Anticonvulsive and antiallergic/antiasthmatic pyrazolo-[3,4-d]pyrimidines, and process for preparing ARZNEIMITTELWERK DRESDEN GMBH (DE) 2000-04-25 US disclosed