SCHEMBL7611149

SCHEMBL7611149

O=C(NCc1ccc(-c2csnn2)cc1)c1cccc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTTP P55157 11/20 0.48
APOB P04114 2/20 0.48
ROCK2 O75116 1/20 0.48
GRK2 P25098 1/20 0.48
KDM1A O60341 1/20 0.48
HDAC1 Q13547 1/20 0.48
PTPN1 P18031 1/20 0.48
PPARG P37231 1/20 0.46
NR1H4 Q96RI1 1/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 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
SCHEMBL7607440 0.89 MTTP (0.57) MTTPAPOBKDM1AHDAC1PPARG
SCHEMBL7613634 0.88 ROCK2 (0.56) MTTPAPOBROCK2GRK2KDM1A
SCHEMBL7606402 0.87 MTTP (0.57) MTTPAPOBPPARGALDH1A1
SCHEMBL7609363 0.87 MTTP (0.57) MTTPAPOBPPARGALDH1A1
SCHEMBL7612180 0.87 MTTP (0.61) MTTPAPOBPPARGNR1H4ALDH1A1
SCHEMBL7613057 0.86 MTTP (0.54) MTTPAPOBROCK2GRK2KDM1A
SCHEMBL7609454 0.86 PPARG (0.59) MTTPAPOBPPARGALDH1A1
SCHEMBL7608067 0.86 MTTP (0.54) MTTPAPOBKDM1AHDAC1PPARG
SCHEMBL7613600 0.86 MTTP (0.58) MTTPAPOBPPARGNR1H4
SCHEMBL7607281 0.85 LMNA (0.55) MTTPAPOBROCK2GRK2PPARG

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 MTTP 1/4885APOB 45/4885ROCK2 4734/4885

“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.