SCHEMBL10916705

SCHEMBL10916705

CC(=O)Oc1ccc2c(c1)COC(=O)N2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.53
ALDH1A1 P00352 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
PDE3B Q13370 2/20 0.50
PDE3A Q14432 2/20 0.50
CYP11B1 P15538 2/20 0.44
CYP11B2 P19099 2/20 0.44
NR3C2 P08235 1/20 0.43
KDM4E B2RXH2 5/20 0.41
GLA P06280 3/20 0.41
GAA P10253 3/20 0.41
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
POLB P06746 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
FLT3 P36888 1/20 0.40
CA2 P00918 1/20 0.40
CA5A P35218 1/20 0.40
PTGS2 P35354 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL6606966 0.82 PDE3B (0.56) MAPTALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL10918945 0.81 PDE3B (0.59) MAPTALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL28346887 0.78 GAA (0.52) MAPTALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL27485474 0.77 MAOA (0.53) ALDH1A1PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL10918430 0.75 SMN1; SMN2 (0.42) MAPTALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL2729559 0.75 MAPT (0.64) MAPTALDH1A1SMN1; SMN2KDM4EGAA
SCHEMBL10532415 0.74 GRIN2D (0.51) MAPTALDH1A1SMN1; SMN2CYP11B1CYP11B2
SCHEMBL10921282 0.74 PDE3B (0.58) PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL14816279 0.74 PDE3B (0.50) ALDH1A1PDE3BPDE3ACYP11B1CYP11B2
SCHEMBL10916724 0.73 CYP11B1 (0.51) MAPTALDH1A1PDE3BPDE3ACYP11B1

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-0093922-B1 BENZOXAZIN-2-ONES, THEIR PREPARATION AND THERAPEUTIC AGENTS CONTAINING THESE COMPOUNDS Dr. Karl Thomae GmbH (DE) 1986-12-30 EP disclosed
US-4518597-A THROMBOSIS, ARTERIOSCLEROSIS, ANTITUMOR, ANTICOAGULANTS DR. KARL THOMAE GMBH (DE) 1985-05-21 US disclosed
EP-0093922-A2 Benzoxazin-2-ones, their preparation and therapeutic agents containing these compounds Dr. Karl Thomae GmbH (DE) 1983-11-16 EP disclosed