SCHEMBL9602844

SCHEMBL9602844

Cc1ccc2c(c1)C1=NN(c3ccc(O)cc3)C(=O)CC1CC2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.35
PARP1 P09874 1/20 0.34
PARP10 Q53GL7 1/20 0.34
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
MAOB P27338 2/20 0.34
PRKCZ Q05513 1/20 0.33
POLB P06746 1/20 0.33
MAP3K7 O43318 1/20 0.33
TAB1 Q15750 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 2/20 0.33
GAA P10253 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
GLA P06280 1/20 0.33
MAPT P10636 1/20 0.33
CASP3 P42574 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL9866597 0.93 PBRM1 (0.37) PTGS1PTGS2MAOBPRKCZPOLB
SCHEMBL10365809 0.93 ACHE (0.38) ACHEPARP1PARP10PTGS1PTGS2
SCHEMBL9865057 0.92 PBRM1 (0.39) PTGS1PTGS2ALDH1A1MAPK1GAA
SCHEMBL9865118 0.89 EP300 (0.35) ACHEPRKCZPOLBALDH1A1MAPK1
SCHEMBL10367467 0.89 MAPT (0.44) ACHEPARP1PARP10PTGS1PTGS2
SCHEMBL10367572 0.88 KDM4E (0.44) ACHEPTGS1PTGS2ALDH1A1MAPK1
SCHEMBL9601978 0.88 MEN1 (0.35) PARP1PARP10PTGS2MAOBPRKCZ
SCHEMBL10660494 0.88 KDM4E (0.34) PTGS1PTGS2PRKCZALDH1A1MAPK1
SCHEMBL9601954 0.88 MAOB (0.40) ACHEPARP1PARP10PTGS1PTGS2
SCHEMBL10365856 0.87 APP (0.44) POLBALDH1A1GAAKDM4ENPC1

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-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed