SCHEMBL3064381

SCHEMBL3064381

Cc1cnccc1C(=O)N(Cc1ccccc1)c1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.48
NOS3 P29474 1/20 0.46
NOS1 P29475 1/20 0.46
NOS2 P35228 1/20 0.46
TSHR P16473 2/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 2/20 0.44
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PDK1 Q15118 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 2/20 0.40
TACR1 P25103 1/20 0.40
MEN1 O00255 1/20 0.39
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL3177779 0.88 TRPM8 (0.62) TRPM8TSHRGAAKMT2AMAPK1
SCHEMBL3054114 0.86 TRPM8 (0.49) RAB9ATRPM8NOS3NOS1NOS2
SCHEMBL3066044 0.86 TRPM8 (0.47) RAB9ATRPM8NOS3NOS1NOS2
SCHEMBL3052135 0.85 TRPM8 (0.48) TRPM8NOS3NOS1NOS2TSHR
SCHEMBL3057326 0.85 TRPM8 (0.51) RAB9ATRPM8TSHRGAAKMT2A
SCHEMBL3057509 0.84 TRPM8 (0.45) TRPM8TSHRGAAKMT2AMAPK1
SCHEMBL3065409 0.84 GAA (0.63) RAB9ATRPM8TSHRGAAKMT2A
SCHEMBL3054727 0.84 GAA (0.53) RAB9ATSHRGAAPDK1ALDH1A1
SCHEMBL3058475 0.83 NOS3 (0.43) RAB9ATRPM8NOS3NOS1NOS2
SCHEMBL3043454 0.83 ALDH1A1 (0.47) TRPM8TSHRGAAKMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100261758-A1 HETEROCYCLIC AMIDES FOR USE AS PHARMACEUTICALS NOVARTIS AG (CH) 2010-10-14 US disclosed
CN-101405268-A Amide derivatives and their use for the treatment of protein-related diseases NOVARTIS AG (CH) 2009-04-08 CN 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-20100261758-A1 HETEROCYCLIC AMIDES FOR USE AS PHARMACEUTICALS HRH4, CNR1, CNR2 RAB9A 1263/4885TRPM8 1707/4885NOS3 3019/4885

“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.