SCHEMBL3058475

SCHEMBL3058475

Cc1cnccc1C(=O)N(Cc1ccccc1)c1ccc(F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.43
NOS1 P29475 1/20 0.43
NOS2 P35228 1/20 0.43
CYP3A4 P08684 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
PDK1 Q15118 12/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL3066044 0.90 TRPM8 (0.47) NOS3NOS1NOS2CYP3A4TRPM8
SCHEMBL3050876 0.89 PDK1 (0.46) NOS3NOS1NOS2CYP3A4TRPM8
SCHEMBL3052135 0.88 TRPM8 (0.48) NOS3NOS1NOS2TRPM8PDK1
SCHEMBL3049921 0.86 TSPO (0.46) NOS3NOS1NOS2ALDH1A1TP53
SCHEMBL3058597 0.85 TACR1 (0.43) CYP3A4TRPM8PDK1ALDH1A1MAPT
SCHEMBL3064381 0.83 RAB9A (0.49) NOS3NOS1NOS2CYP3A4TRPM8
SCHEMBL3054727 0.82 GAA (0.53) PDK1ALDH1A1MAPTRAB9AGAA
SCHEMBL3048580 0.82 RAB9A (0.44) NOS3NOS1NOS2TRPM8PDK1
SCHEMBL3177779 0.81 TRPM8 (0.62) TRPM8PDK1ALDH1A1MAPTTP53
SCHEMBL3044246 0.81 RAB9A (0.57) NOS3NOS1NOS2PDK1ALDH1A1

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 NOS3 3019/4885NOS1 3682/4885NOS2 3548/4885

“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.