SCHEMBL516075

SCHEMBL516075

Cc1cc(OCc2ccccc2)cc(C)c1C1=C(CC(C)(C)C(=O)O)C2C3C=C[C@H](O3)[C@@H]2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
S1PR1 P21453 1/20 0.35
S1PR5 Q9H228 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
MAOB P27338 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MAOA P21397 2/20 0.34
PKM P14618 1/20 0.34
NPC1 O15118 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PPARG P37231 1/20 0.33
CASP1 P29466 1/20 0.33
SLC26A3 P40879 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
SCHEMBL10187547 0.82 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL13262087 0.82 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL16281722 0.81 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL515606 0.81 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL515605 0.81 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL13261958 0.81 FFAR1 (0.41) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL515937 0.69 MAOB (0.43) MEN1KMT2AS1PR1S1PR5MRGPRX4
SCHEMBL515854 0.69 MAOB (0.43) MEN1KMT2AS1PR1S1PR5MRGPRX4
SCHEMBL10187570 0.69 FFAR1 (0.43) FFAR1MEN1KMT2AS1PR1S1PR5
SCHEMBL10187560 0.69 FFAR1 (0.43) FFAR1MEN1KMT2AS1PR1S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 FFAR1 752/4885MEN1 4280/4885KMT2A 674/4885

“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.