SCHEMBL10653570

SCHEMBL10653570

O=CC1Oc2cc(F)ccc2NC1=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 5/20 0.37
▸ TP53 P04637 1/20 0.36
▸ CREBBP Q92793 3/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PGR P06401 3/20 0.34
▸ MAOB P27338 6/20 0.33
▸ NR3C1 P04150 1/20 0.33
▸ AR P10275 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA9 Q16790 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
SCHEMBL10654406 0.84 BRD4 (0.35) BRD4TP53CREBBPPARP1KMT2A
SCHEMBL28826462 0.78 BRD4 (0.38) BRD4TP53CREBBPPARP1KMT2A
SCHEMBL4824516 0.78 PARP1 (0.60) BRD4CREBBPPARP1KMT2APGR
SCHEMBL10358498 0.74 BRD4 (0.55) BRD4CREBBPPARP1KMT2APGR
SCHEMBL12850583 0.74 TP53 (0.51) TP53KMT2A
SCHEMBL8904957 0.73 PARP1 (0.40) BRD4TP53CREBBPPARP1KMT2A
SCHEMBL30991575 0.73 BRD4 (0.55) BRD4CREBBPPARP1PGRMAOB
SCHEMBL8904960 0.73 PARP1 (0.40) BRD4TP53CREBBPPARP1KMT2A
SCHEMBL27590550 0.72 MAOB (0.33) KMT2APGRMAOB
SCHEMBL7466727 0.72 L3MBTL1 (0.53) BRD4TP53CREBBPKMT2APGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0290863-A2 Benzoxazine derivative, process and intermediates for its preparation and its use as herbicide NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-11-17 — — EP disclosed
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