SCHEMBL515937

SCHEMBL515937

Cc1cc(OCc2ccccc2)cc(C)c1C1C(=O)C2C3C=CC(O3)C2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.43
MAOA P21397 5/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 3/20 0.43
PKM P14618 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NSD2 O96028 1/20 0.41
ABL1 P00519 1/20 0.41
PPARG P37231 1/20 0.41
RIN1 Q13671 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
GRM5 P41594 2/20 0.41
ACHE P22303 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 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
SCHEMBL515854 1.00 MAOB (0.43) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL515347 0.84 SRD5A1 (0.41) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL516169 0.84 MAOB (0.41) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL515457 0.84 MAOB (0.43) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL516265 0.79 TOP1 (0.49) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL13262087 0.75 FFAR1 (0.41) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL10187547 0.75 FFAR1 (0.41) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL403344 0.75 MAOB (0.53) MAOBMAOAL3MBTL1RAB9ANPC1
SCHEMBL8901906 0.73 MAOB (0.56) MAOBMAOAL3MBTL1RAB9ANPC1
Hydrochloric Acid SCHEMBL29763734 0.72 MAOB (0.55) MAOBMAOAL3MBTL1RAB9ANPC1

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-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US 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 (1 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MAOB 2064/4885MAOA 2359/4885L3MBTL1 1453/4885

“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.