SCHEMBL7150583

SCHEMBL7150583

O=C(Nc1ccccc1)c1ccc(OC(F)(F)F)c(Nc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
RXFP1 Q9HBX9 8/20 0.59
MPO P05164 1/20 0.57
MAPT P10636 3/20 0.56
KCNK3 O14649 1/20 0.56
AURKA O14965 1/20 0.53
P2RX1 P51575 1/20 0.52
AKR1C3 P42330 1/20 0.52
AKR1C2 P52895 1/20 0.52
LCK P06239 1/20 0.52
KIT P10721 1/20 0.52
SRC P12931 1/20 0.52
MAPK14 Q16539 1/20 0.52
POLB P06746 1/20 0.52
APEX1 P27695 1/20 0.52
MEN1 O00255 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
KMT2A Q03164 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
SCHEMBL7150500 0.93 RXFP1 (0.54) LMNARXFP1MPOMAPTKCNK3
SCHEMBL7152098 0.89 RXFP1 (0.65) LMNARXFP1MPOMAPTKCNK3
SCHEMBL7150586 0.86 MAPT (0.60) LMNARXFP1MPOMAPTKCNK3
SCHEMBL7147453 0.82 RXFP1 (0.61) LMNARXFP1MPOMAPTLCK
SCHEMBL7154486 0.81 LMNA (0.63) LMNARXFP1MPOMAPTKCNK3
SCHEMBL6813680 0.81 RXFP1 (0.53) LMNARXFP1MAPTKCNK3POLB
SCHEMBL7155509 0.80 LMNA (0.62) LMNARXFP1MPOMAPTKCNK3
SCHEMBL7150180 0.79 RXFP1 (0.60) RXFP1MPOMAPTLCKKIT
SCHEMBL7154124 0.78 RXFP1 (0.59) LMNARXFP1MPOMAPTLCK
SCHEMBL4517587 0.78 LMNA (1.00) LMNARXFP1MAPTKCNK3P2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis CONNOR DAVID THOMAS (US) 2001-10-18 US claimed
EP-1042276-A1 THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY LLC (US) 2000-10-11 EP claimed
WO-1999032433-A1 THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO claimed
US-6528528-B2 Inhibitors of 15-lipoxygenase, inhibiting chemotaxis of monocytes WARNER-LAMBERT COMPANY 2003-03-04 US disclosed
US-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis CONNOR DAVID THOMAS (US) 2001-10-18 US disclosed
US-6268387-B1 INHIBITORS OF THE ENZYME 15-LIPOXYGENASE AND ARE INHIBITORS OF MONOCYTE CHEMOTAXIS. WARNER-LAMBERT COMPANY 2001-07-31 US disclosed
EP-1042276-A1 THIOUREA COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY LLC (US) 2000-10-11 EP disclosed
WO-1999032433-A1 THIOUREA AND BENZAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING OR PREVENTING INFLAMMATORY DISEASES AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1999-07-01 WO 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-20010031874-A1 Thiourea and benzamide compounds, compositions and methods of treating or preventing inflammatory diseases and atherosclerosis TPMT, CTH, CBS LMNA 1617/4885RXFP1 2130/4885MPO 250/4885

“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.