SCHEMBL1645546

SCHEMBL1645546

CCNc1cc(Cl)ccc1C

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.60
CYP3A4 P08684 2/20 0.60
RECQL P46063 1/20 0.60
GAA P10253 3/20 0.53
POLB P06746 1/20 0.53
RAPGEF4 Q8WZA2 1/20 0.52
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL22791495 0.84 GAA (0.58) TSHRCYP3A4RECQLGAAPOLB
SCHEMBL11251960 0.83 SMN1; SMN2 (0.50) TSHRCYP3A4RECQLGAAPOLB
SCHEMBL3789681 0.83 SMN1; SMN2 (0.44) TSHRCYP3A4RECQLGAAPOLB
SCHEMBL3398998 0.81 MEN1 (0.50) TSHRGAAPOLBRAPGEF4LMNA
SCHEMBL7653266 0.81 GAA (0.48) TSHRCYP3A4RECQLGAAPOLB
Hydrochloric Acid SCHEMBL6518247 0.79 MEN1 (0.48) TSHRGAAPOLBRAPGEF4LMNA
SCHEMBL12895731 0.79 ALDH1A1 (0.40) TSHRCYP3A4RECQLGAAPOLB
SCHEMBL21131436 0.79 RAPGEF4 (0.47) TSHRGAAPOLBRAPGEF4ALDH1A1
SCHEMBL20673500 0.79 FERMT2 (0.50) TSHRCYP3A4GAAPOLBRAPGEF4
SCHEMBL19905565 0.79 ALDH1A1 (0.55) TSHRGAAPOLBRAPGEF4ALDH1A1

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-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME PFIZER INC. (US) 2012-04-12 US disclosed
US-7998987-B2 Inhibitors of c-Met and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-08-16 US disclosed
US-20100190774-A1 INHIBITORS OF C-MET AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-07-29 US disclosed
US-7728017-B2 Inhibitors of c-Met and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2010-06-01 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-20100190774-A1 INHIBITORS OF C-MET AND USES THEREOF MET, HGF, ABL1 TSHR 1448/4885CYP3A4 4029/4885RECQL 4106/4885
US-20120088746-A1 AMIDE DERIVATIVES AS ION-CHANNEL LIGANDS AND PHARMACEUTICAL COMPOSITIONS AND METHODS OF USING THE SAME TRPV1, TRPA1, TRPV2 TSHR 2959/4885CYP3A4 2021/4885RECQL 3366/4885

“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.