SCHEMBL7608650

SCHEMBL7608650

NC(=O)CCNC(=O)c1cccc(N(C=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.43
BCR P11274 2/20 0.43
KCNA3 P22001 5/20 0.41
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.40
HDAC3 O15379 2/20 0.39
HDAC1 Q13547 2/20 0.39
EPHX2 P34913 2/20 0.39
ALOX5 P09917 1/20 0.37
TP53BP1 Q12888 1/20 0.37
GCGR P47871 1/20 0.37
GIPR P48546 1/20 0.37
GPR52 Q9Y2T5 2/20 0.36
TACR2 P21452 1/20 0.36
TACR1 P25103 1/20 0.36

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
SCHEMBL7611574 0.81 HDAC6 (0.50) POLB
SCHEMBL7609452 0.81 PPARG (0.56) HDAC1
SCHEMBL7608643 0.76 APOB (0.55) EPHX2
SCHEMBL7038640 0.71 MAP4K4 (0.42) ALDH1A1TACR1
SCHEMBL7039775 0.69 HDAC1 (0.42) HDAC1TACR1
SCHEMBL7037179 0.67 PPARG (0.45) HDAC1EPHX2
SCHEMBL7041100 0.67 GSK3B (0.46) HDAC1TACR1
SCHEMBL7039753 0.66 AR (0.42) TACR1
SCHEMBL3659106 0.66 PRSS1 (0.66) POLBHDAC3HDAC1EPHX2
SCHEMBL7109895 0.66 POLB (0.59) ALDH1A1POLBHDAC3HDAC1TP53BP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020032238-A1 Biphenylcarboxylic acid amides, the preparation thereof and the use thereof as medicaments BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-03-14 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 (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-20020032238-A1 Biphenylcarboxylic acid amides, the preparation thereof and the use thereof as medicaments MTTP, CETP, FABP1 ABL1 1697/4885BCR 754/4885KCNA3 4287/4885

“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.