SCHEMBL4110477

SCHEMBL4110477

Cc1ccc(NC(=O)Nc2ccc(OCC#N)cc2)cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.49
NPC1 O15118 7/20 0.49
RAB9A P51151 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
PKM P14618 2/20 0.49
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
HTT P42858 3/20 0.47
LMNA P02545 3/20 0.47
EPHX2 P34913 1/20 0.46
HRH3 Q9Y5N1 2/20 0.46
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
IL18 Q14116 1/20 0.45
STING1 Q86WV6 1/20 0.45
NTRK1 P04629 1/20 0.43
NTRK2 Q16620 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL4118217 0.90 MAPT (0.52) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4113342 0.88 MAPT (0.50) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4113574 0.88 MEN1 (0.51) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4118206 0.84 MAPT (0.67) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4112803 0.83 MEN1 (0.53) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4104760 0.83 MAPT (0.53) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4107055 0.82 MAPT (0.49) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4106349 0.81 SAE1 (0.59) MAPTNPC1RAB9ASMN1; SMN2PKM
SCHEMBL4122424 0.81 CDK8 (0.56) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4111413 0.81 NPC1 (0.59) MAPTNPC1RAB9ASMN1; SMN2KMT2A

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 MAPT 1654/4885NPC1 927/4885RAB9A 815/4885

“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.