SCHEMBL7613634

SCHEMBL7613634

O=C(NCc1ccc(-c2ccncc2)cc1)c1cccc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 7/20 0.56
GRK2 P25098 5/20 0.56
ABL1 P00519 1/20 0.54
EGFR P00533 1/20 0.54
CSF1R P07333 1/20 0.54
PDGFRB P09619 1/20 0.54
KIT P10721 1/20 0.54
FLT1 P17948 1/20 0.54
FLT4 P35916 1/20 0.54
KDR P35968 1/20 0.54
KDM1A O60341 1/20 0.52
HDAC1 Q13547 1/20 0.52
MTTP P55157 6/20 0.52
APOB P04114 2/20 0.52
RXFP1 Q9HBX9 1/20 0.52
RPS6KA5 O75582 1/20 0.51
MAP4K4 O95819 1/20 0.51
PRKCG P05129 1/20 0.51
PRKACA P17612 1/20 0.51
RPS6KB1 P23443 1/20 0.51

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
SCHEMBL7605521 0.95 RXFP1 (0.55) ROCK2GRK2ABL1EGFRCSF1R
SCHEMBL7607440 0.94 MTTP (0.57) KDM1AHDAC1MTTPAPOBMAPK1
SCHEMBL7606402 0.93 MTTP (0.57) MTTPAPOBRXFP1PPARG
SCHEMBL7609363 0.93 MTTP (0.57) MTTPAPOBRXFP1PPARG
SCHEMBL7612180 0.91 MTTP (0.61) MTTPAPOBRXFP1PPARG
SCHEMBL7605798 0.91 LMNA (0.54) ROCK2GRK2MTTPAPOBRXFP1
SCHEMBL7613166 0.91 PPARG (0.53) KDM1AHDAC1MTTPAPOBRXFP1
SCHEMBL7613600 0.91 MTTP (0.58) MTTPAPOBRXFP1PPARG
SCHEMBL7609454 0.91 PPARG (0.59) MTTPAPOBPPARG
SCHEMBL7608067 0.91 MTTP (0.54) KDM1AHDAC1MTTPAPOBPPARG

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 ROCK2 4734/4885GRK2 3440/4885ABL1 1697/4885

“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.