SCHEMBL7122079

SCHEMBL7122079

Nc1cccc(C(O)C(Cl)(Cl)Cl)c1O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.37
TSHR P16473 3/20 0.34
CYP3A4 P08684 2/20 0.34
HPGD P15428 2/20 0.34
FAAH O00519 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB1 P18505 1/20 0.34
GABRG2 P18507 1/20 0.34
PTGS1 P23219 1/20 0.34
SLC6A2 P23975 1/20 0.34
HTR2C P28335 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
HTR2B P41595 1/20 0.34
GABRA2 P47869 1/20 0.34

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
SCHEMBL7122576 0.81 MMP2 (0.37) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL7126782 0.80 LMNA (0.44) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL7128980 0.77 ALDH1A1 (0.48) TSHRCYP3A4HPGDFAAHCA1
SCHEMBL7118915 0.77 G6PD (0.37) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL14895142 0.74 TSHR (0.48) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL103975 0.71 GABRA1 (0.70) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL27528386 0.71 MMP2 (0.42) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL7131111 0.71 GABRA1 (0.48) MMP2TSHRCYP3A4HPGDCA1
SCHEMBL14895418 0.71 LMNA (0.45) MMP2TSHRCYP3A4HPGDFAAH
SCHEMBL16738113 0.70 MMP2 (0.35) MMP2TSHRCYP3A4HPGDFAAH

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
US-20030144541-A1 Process for preparing alpha-halogenated retones RHODIA CHIMIE (FR) 2003-07-31 US disclosed
EP-1250303-A1 METHOD FOR PREPARING ALPHA-HALOGENATED KETONES RHODIA CHIMIE (FR) 2002-10-23 EP disclosed
WO-2001055067-A1 METHOD FOR PREPARING ALPHA-HALOGENATED KETONES RHODIA CHIMIE (FR) 2001-08-02 WO 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-20030144541-A1 Process for preparing alpha-halogenated retones ADH1A, ADH1C, RER1 MMP2 4580/4885TSHR 1088/4885CYP3A4 492/4885

“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.