SCHEMBL19665206

SCHEMBL19665206

CCOC(=O)Cc1ccc2[nH]cc(/C=C/C(=O)O)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.48
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ATM Q13315 1/20 0.48
▸ PKM P14618 2/20 0.47
▸ GABRA1 P14867 2/20 0.46
▸ GABRB2 P47870 2/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ TDO2 P48775 1/20 0.45
▸ GABRB1 P18505 1/20 0.44
▸ GABRA3 P34903 1/20 0.44
▸ CHRNA7 P36544 1/20 0.41
▸ MTNR1A P48039 1/20 0.40
▸ MTNR1B P49286 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ NFKB1 P19838 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
SCHEMBL17871766 1.00 MAPT (0.48) MAPTMEN1KMT2AKDM4EATM
SCHEMBL19665114 0.87 MAPT (0.46) MAPTMEN1KMT2AKDM4EATM
SCHEMBL17871706 0.86 ALDH1A1 (0.50) MAPTMEN1KMT2AKDM4EATM
SCHEMBL19665113 0.81 GABRA1 (0.45) MAPTPKMGABRA1GABRB2ALDH1A1
SCHEMBL7478350 0.78 GABRA1 (0.67) MEN1KMT2APKMGABRA1GABRB2
SCHEMBL7837824 0.77 MAPT (0.54) MAPTMEN1KMT2AKDM4EATM
SCHEMBL31447925 0.76 TDO2 (0.56) MAPTMEN1KMT2AKDM4EATM
SCHEMBL15229561 0.76 TDO2 (0.56) MAPTMEN1KMT2AKDM4EATM
SCHEMBL15229559 0.76 TDO2 (0.56) MAPTMEN1KMT2AKDM4EATM
SCHEMBL15245773 0.75 MAPT (0.58) MAPTMEN1KMT2AKDM4EATM

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-3237396-B1 HETEROCYCLIC DERIVATIVES AS RORGAMMA MODULATORS GENFIT (FR) 2019-07-03 — — EP disclosed
US-9902725-B2 Heterocyclic derivatives as RORgamma modulators GENFIT (FR) 2018-02-27 — — US disclosed
US-20170349582-A1 HETEROCYCLIC DERIVATIVES AS RORGAMMA MODULATORS GENFIT (FR) 2017-12-07 — — 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-20170349582-A1 HETEROCYCLIC DERIVATIVES AS RORGAMMA MODULATORS RORC, RORB, RORA MAPT 4093/4885MEN1 3408/4885KMT2A 2603/4885

“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.

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