SCHEMBL5862971

SCHEMBL5862971

CCc1ccccc1C(=O)[N]C(=O)c1ccccc1CC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 2/20 0.43
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
TSHR P16473 2/20 0.42
F2R P25116 1/20 0.41
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
MGLL Q99685 1/20 0.39
HTT P42858 3/20 0.39
FOLH1 Q04609 1/20 0.38
HPGD P15428 1/20 0.38
HDAC3 O15379 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC2 Q92769 1/20 0.38
SLC9A1 P19634 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
SCHEMBL5861888 0.86 FOLH1 (0.43) CLCN2TSHRALDH1A1TP53HTT
SCHEMBL29344686 0.85 CLCN2 (0.42) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL8814289 0.82 CLCN2 (0.40) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL8995207 0.82 CLCN2 (0.40) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL8814283 0.82 CLCN2 (0.40) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL11412880 0.80 GABRA1 (0.44) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL2935940 0.79 GABRA1 (0.48) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL7991056 0.79 NPSR1 (0.39) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL7987828 0.79 CLCN2 (0.38) CLCN2GABRA1GABRB2TSHRF2R
SCHEMBL49956 0.77 TSHR (0.50) CLCN2GABRA1GABRB2TSHRF2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7094516-B2 Benzobisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2006-08-22 US disclosed
EP-1180765-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS INC (JP) 2005-04-06 EP disclosed
EP-1484191-A1 REWRITABLE OPTICAL INFORMATION RECORDING MEDIUM AND RECORDING/REPRODUCING METHOD, RECORDING/REPRODUCING DEVICE Sony Corporation (JP) 2004-12-08 EP disclosed
US-6627288-B1 Optical recording medium and porphycene compound MITSUI CHEMICALS, INC. (JP) 2003-09-30 US disclosed
US-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound MITSUI CHEMICALS, INC. (JP) 2003-05-15 US disclosed
EP-1245571-A1 BENZBISAZOLE COMPOUND AND OPTICAL RECORDING MEDIUM CONTAINING THE COMPOUND Mitsui Chemicals, Inc. (JP) 2002-10-02 EP disclosed
EP-1180765-A1 Optical recording medium and porphycene compound Mitsui Chemicals, Inc. (JP) 2002-02-20 EP 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-20030091931-A1 Benzbisazole compound and optical recording medium containing the compound DAO, CACNA1I, KCNB2 CLCN2 523/4885GABRA1 140/4885GABRB2 91/4885

“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.