SCHEMBL6295489

SCHEMBL6295489

O=C1COc2cc(OCc3ccccc3)ccc2N1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.62
MAOA P21397 10/20 0.62
CREBBP Q92793 4/20 0.55
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
NFKB1 P19838 1/20 0.53
GRM5 P41594 1/20 0.53
RAB9A P51151 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
BRD4 O60885 3/20 0.51
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
PARP1 P09874 1/20 0.50

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
SCHEMBL5496459 0.90 MAOB (0.61) MAOBMAOACREBBPNPC1ALDH1A1
SCHEMBL22369086 0.87 MAOB (0.65) MAOBMAOACREBBPNPC1ALDH1A1
SCHEMBL18794867 0.87 MAOB (0.64) MAOBMAOACREBBPNPC1GRM5
Water SCHEMBL2536819 0.84 PARP1 (0.57) MAOBMAOACREBBPNPC1ALDH1A1
SCHEMBL18794868 0.84 MAOB (0.48) MAOBMAOACREBBPNPC1GRM5
SCHEMBL18794870 0.84 MAOB (0.48) MAOBMAOACREBBPNPC1RAB9A
SCHEMBL17673304 0.79 CREBBP (0.80) MAOBMAOACREBBPBRD4
SCHEMBL19518160 0.79 CREBBP (0.80) MAOBMAOACREBBPBRD4
SCHEMBL24508418 0.78 PDE3B (0.57) MAOBMAOACREBBPALDH1A1BRD4
SCHEMBL293145 0.78 PDE3B (0.57) MAOBMAOACREBBPALDH1A1BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180312480-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS TRILLIUM THERAPEUTICS INC. (CA) 2018-11-01 US claimed
EP-3371154-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS Trillium Therapeutics Inc. (CA) 2018-09-12 EP claimed
WO-2017070796-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS TRILLIUM THERAPEUTICS INC. (CA) 2017-05-04 WO claimed
US-6951855-B2 Benzoxazinone derivatives for use in the treatment of angiogenesis ASTRAZENECA AB (SE) 2005-10-04 US claimed
US-20040122006-A1 Benzoxazinone derivatives for use in the treatment of angiogenesis ASTRAZENECA AB (SE) 2004-06-24 US claimed
EP-1385835-A1 BENZOXAZINONE DERIVATIVES FOR USE IN THE TREATMENT OF ANGIOGENESIS Astrazeneca AB (SE) 2004-02-04 EP claimed
WO-2002085868-A1 BENZOXAZINONE DERIVATIVES FOR USE IN THE TREATMENT OF ANGIOGENESIS ASTRAZENECA AB (SE) 2002-10-31 WO claimed
WO-2021231933-A1 ANTI-EPILEPTIC PHARMACEUTICAL COMPOSITIONS AND USE THEREOF NEUCYTE PHARMACEUTICALS (US) 2021-11-18 WO disclosed
US-10428030-B2 Heterocycle derivatives and their use for the treatment of CNS disorders Trillium Therapeutics (CA) 2019-10-01 US disclosed
US-10428030-B2 Heterocycle derivatives and their use for the treatment of CNS disorders Trillium Therapeutics (CA) 2019-10-01 US disclosed
US-20180312480-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS TRILLIUM THERAPEUTICS INC. (CA) 2018-11-01 US disclosed
EP-3371154-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS Trillium Therapeutics Inc. (CA) 2018-09-12 EP disclosed
WO-2017070796-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS TRILLIUM THERAPEUTICS INC. (CA) 2017-05-04 WO disclosed
WO-2017070796-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS TRILLIUM THERAPEUTICS INC. (CA) 2017-05-04 WO disclosed
US-6951855-B2 Benzoxazinone derivatives for use in the treatment of angiogenesis ASTRAZENECA AB (SE) 2005-10-04 US disclosed
US-20040122006-A1 Benzoxazinone derivatives for use in the treatment of angiogenesis ASTRAZENECA AB (SE) 2004-06-24 US disclosed
EP-1385835-A1 BENZOXAZINONE DERIVATIVES FOR USE IN THE TREATMENT OF ANGIOGENESIS Astrazeneca AB (SE) 2004-02-04 EP disclosed
WO-2002085868-A1 BENZOXAZINONE DERIVATIVES FOR USE IN THE TREATMENT OF ANGIOGENESIS ASTRAZENECA AB (SE) 2002-10-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180312480-A1 HETEROCYCLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS GRIN2C, ACHE, CNR1 MAOB 164/4885MAOA 264/4885CREBBP 125/4885
US-20040122006-A1 Benzoxazinone derivatives for use in the treatment of angiogenesis HAX1, VEGFA, HYOU1 MAOB 1050/4885MAOA 1737/4885CREBBP 2000/4885
US-10428030-B2 Heterocycle derivatives and their use for the treatment of CNS disorders GRIN2C, ACHE, CNR1 MAOB 164/4885MAOA 264/4885CREBBP 125/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.