SCHEMBL4124124

SCHEMBL4124124

COc1cccc(NC(=O)Nc2ccc(C)c(F)c2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.71
MAPT P10636 8/20 0.71
NPC1 O15118 8/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
TP53 P04637 2/20 0.69
TSHR P16473 1/20 0.69
HTT P42858 4/20 0.63
PKM P14618 2/20 0.63
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.61
LMNA P02545 2/20 0.61
MAPK1 P28482 2/20 0.61
STAT1 P42224 1/20 0.61
ALDH1A1 P00352 2/20 0.60
MITF O75030 1/20 0.60
USP2 O75604 1/20 0.60
GAA P10253 1/20 0.60
ALOX15 P16050 1/20 0.60
HSD17B10 Q99714 1/20 0.60
CASP3 P42574 1/20 0.59

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
SCHEMBL4121882 0.87 MAPT (0.68) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4112390 0.86 MAPT (0.58) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4111961 0.86 CA2 (0.60) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4346922 0.86 TP53 (0.69) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL22103791 0.85 TSHR (0.82) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4110798 0.85 NPC1 (0.57) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4893387 0.85 TP53 (0.87) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL31040569 0.85 TP53 (0.87) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4346603 0.84 TP53 (0.67) RAB9AMAPTNPC1SMN1; SMN2TP53
SCHEMBL4112574 0.84 NPC1 (0.56) RAB9AMAPTNPC1SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 US disclosed
US-20090239841-A1 Diaryl Ureas as CB1 Antagonists NEUROGEN CORPORATION 2009-09-24 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-20090239841-A1 Diaryl Ureas as CB1 Antagonists CNR1, CNR2, OPRL1 RAB9A 815/4885MAPT 1654/4885NPC1 927/4885

“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.