SCHEMBL4884664

SCHEMBL4884664

CSC(=Nc1ccc(Cl)cc1)N1Cc2ccccc2C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.47
TAS1R1 Q7RTX1 2/20 0.47
TAS1R2 Q8TE23 2/20 0.47
NOS1 P29475 5/20 0.46
NOS3 P29474 4/20 0.46
NOS2 P35228 4/20 0.46
NOTUM Q6P988 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
AKR1C3 P42330 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
HTR3E A5X5Y0 1/20 0.37
SLC22A2 O15244 1/20 0.37

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
SCHEMBL8259700 1.00 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2NOS1NOS3
SCHEMBL4884658 1.00 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2NOS1NOS3
SCHEMBL8257533 0.85 KMT2A (0.46) TAS1R3TAS1R1TAS1R2NOS1NOS3
SCHEMBL4882869 0.85 KMT2A (0.46) TAS1R3TAS1R1TAS1R2NOS1NOS3
SCHEMBL4882867 0.85 KMT2A (0.46) TAS1R3TAS1R1TAS1R2NOS1NOS3
SCHEMBL4881917 0.84 DPP8 (0.40) NOS1NOS3NOS2NAMPT
SCHEMBL4881919 0.84 DPP8 (0.40) NOS1NOS3NOS2NAMPT
SCHEMBL14066260 0.84 DPP8 (0.40) NOS1NOS3NOS2NAMPT
SCHEMBL4885312 0.82 NAMPT (0.41) NOS1NOS3NOS2NAMPT
SCHEMBL4885311 0.82 NAMPT (0.41) NOS1NOS3NOS2NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234252-A1 Compounds Useful in Therapy PFIZER INC 2008-09-25 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-20080234252-A1 Compounds Useful in Therapy AVPR1A, AVPR1B, AVPR2 TAS1R3 1373/4885TAS1R1 1314/4885TAS1R2 1768/4885

“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.