SCHEMBL4881919

SCHEMBL4881919

CSC(=Nc1ccc(Cl)cc1)N1Cc2cccnc2C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
NOS3 P29474 2/20 0.38
NOS1 P29475 2/20 0.38
NOS2 P35228 2/20 0.38
NAMPT P43490 17/20 0.38

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
SCHEMBL4881917 1.00 DPP8 (0.40) DPP8DPP9NOS3NOS1NOS2
SCHEMBL14066260 1.00 DPP8 (0.40) DPP8DPP9NOS3NOS1NOS2
SCHEMBL8259700 0.84 TAS1R3 (0.47) NOS3NOS1NOS2NAMPT
SCHEMBL4884664 0.84 TAS1R3 (0.47) NOS3NOS1NOS2NAMPT
SCHEMBL4884658 0.84 TAS1R3 (0.47) NOS3NOS1NOS2NAMPT
SCHEMBL8257533 0.74 KMT2A (0.46) NOS3NOS1NOS2
SCHEMBL4882869 0.74 KMT2A (0.46) NOS3NOS1NOS2
SCHEMBL4882867 0.74 KMT2A (0.46) NOS3NOS1NOS2
SCHEMBL19480252 0.72 DPP8 (0.53) DPP8DPP9NAMPT
SCHEMBL4878469 0.71 SMN1; SMN2 (0.51) NAMPT

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 DPP8 2678/4885DPP9 3915/4885NOS3 1527/4885

“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.