SCHEMBL10508693

SCHEMBL10508693

O=C(O)c1ccc2c(=O)[nH]nc(C(=O)O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.48
CSNK2A1 P68400 2/20 0.48
KDM4E B2RXH2 2/20 0.43
RECQL P46063 1/20 0.41
PRKAB2 O43741 1/20 0.41
PRKAG1 P54619 1/20 0.41
PRKAA2 P54646 1/20 0.41
PRKAA1 Q13131 1/20 0.41
PRKAG3 Q9UGI9 1/20 0.41
PRKAG2 Q9UGJ0 1/20 0.41
PRKAB1 Q9Y478 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
CYP1A2 P05177 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL11170521 0.82 ROCK1 (0.46) PARP1KDM4EPRKAB2PRKAG1PRKAA2
SCHEMBL2463881 0.82 PARP1 (0.45) PARP1CSNK2A1KDM4ERECQLLMNA
SCHEMBL27384820 0.82 POLB (0.46) KDM4EPRKAG1PRKAA1PRKAB1KMT2A
SCHEMBL2462240 0.82 PARP1 (0.45) PARP1CSNK2A1KDM4ERECQLLMNA
SCHEMBL29735258 0.82 ALDH1A1 (0.49) PARP1KDM4EPRKAA1LMNAKMT2A
SCHEMBL23098990 0.82 ALDH1A1 (0.49) PARP1KDM4EPRKAA1LMNAKMT2A
SCHEMBL2446205 0.79 KDM4E (0.65) PARP1KDM4ELMNAKMT2AALDH1A1
SCHEMBL4055439 0.79 PARP1 (0.42) PARP1CSNK2A1KDM4ERECQLLMNA
SCHEMBL2463004 0.79 MAP2K4 (0.44) PARP1CSNK2A1KDM4ERECQLALDH1A1
SCHEMBL19328981 0.78 PARP1 (0.48) PARP1CSNK2A1KDM4ELMNAKMT2A

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-0164593-B1 ANTI-INFLAMMATORY PHTHALAZINONES FISONS CORPORATION (US) 1989-11-15 EP disclosed
US-4665181-A Anti-inflammatory phthalazinones PENNWALT CORPORATION (US) 1987-05-12 US disclosed
EP-0164593-A1 Anti-inflammatory phthalazinones FISONS CORPORATION (US) 1985-12-18 EP disclosed