SCHEMBL3527600

SCHEMBL3527600

COC(=O)CCC#Cc1cc(Cl)ccc1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
ABL1 P00519 1/20 0.42
EGFR P00533 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 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
SCHEMBL3528298 0.92 MAPT (0.47) MAPTABL1EGFRCYP1A2CYP3A4
SCHEMBL3527495 0.91 MAPT (0.46) MAPTABL1EGFRCYP1A2CYP3A4
SCHEMBL3520159 0.84 GABRP (0.37) MAPTCYP1A2CYP3A4CYP2C19GAA
SCHEMBL3524291 0.84 KDM4E (0.43) MAPTEGFRCYP1A2GAAMEN1
SCHEMBL3526355 0.83 L3MBTL1 (0.38) MAPTGAAL3MBTL1GABRPGABRD
SCHEMBL3524025 0.83 CREBBP (0.40) MAPTGAAMEN1KMT2AGABRP
SCHEMBL3524209 0.82 GABRP (0.41) MAPTCYP1A2CYP3A4CYP2C19GAA
SCHEMBL3526404 0.81 ALDH1A1 (0.43) MAPTCYP1A2CYP3A4CYP2C19GAA
SCHEMBL3526109 0.81 CFTR (0.46) MAPTCYP1A2CYP2C19GAAKMT2A
SCHEMBL3524738 0.80 ALDH1A1 (0.53) MAPTCYP1A2CYP3A4CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436040-B2 Method of treating conditions involving PPAR-receptors with indole compounds LABORATOIRES FOURNIER S.A. (FR) 2013-05-07 US disclosed
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds LABORATORIES FOURNIER S.A. (FR) 2010-11-11 US disclosed
US-7795297-B2 Indole compounds, method of preparing them and uses thereof LABORATORIES FOURNIER S.A. (FR) 2010-09-14 US disclosed
US-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LABORATOIRES FOURNIER S.A. (FR) 2008-06-26 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-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LIPG, GPR119, IAPP MAPT 214/4885ABL1 1317/4885EGFR 1560/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG MAPT 730/4885ABL1 2952/4885EGFR 456/4885

“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.