SCHEMBL19732569

SCHEMBL19732569

CCc1cccc(=O)n1O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 15/20 0.58
DAO P14920 1/20 0.41
GABRA1 P14867 1/20 0.38
GABRB2 P47870 1/20 0.38
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL24120771 0.83 IDH1 (0.62) IDH1DAOLMNAPKM
SCHEMBL17770627 0.80 IDH1 (0.60) IDH1
SCHEMBL24120703 0.78 IDH1 (0.53) IDH1
SCHEMBL24120736 0.78 IDH1 (0.53) IDH1GABRA1GABRB2
SCHEMBL15112068 0.77 IDH1 (0.56) IDH1
SCHEMBL16093372 0.76 CA12 (0.38) IDH1GABRA1GABRB2LMNA
SCHEMBL13193519 0.74 ALDH1A1 (0.39) IDH1GABRA1GABRB2LMNA
SCHEMBL24120709 0.74 IDH1 (0.53) IDH1LMNA
SCHEMBL24120715 0.74 IDH1 (0.53) IDH1LMNA
SCHEMBL27016819 0.72 IDH1 (0.38) IDH1GABRA1GABRB2

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-10434186-B2 Functionalized linear ligands and complexes thereof LUMIPHORE, INC. (US) 2019-10-08 US disclosed
US-20170360956-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF LUMIPHORE, INC. 2017-12-21 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 (2 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-20170360956-A1 FUNCTIONALIZED LINEAR LIGANDS AND COMPLEXES THEREOF CLTB, CLTA, EPCAM IDH1 613/4885DAO 1644/4885GABRA1 1631/4885
US-10434186-B2 Functionalized linear ligands and complexes thereof CLTB, CLTA, EPCAM IDH1 613/4885DAO 1644/4885GABRA1 1631/4885

“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.