SCHEMBL20682199

SCHEMBL20682199

CC(C)(C)N1CC2CCC(C1)N2C(=O)CCC(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.33
NPC1 O15118 1/20 0.33
DPP4 P27487 1/20 0.33
JAK2 O60674 2/20 0.33
JAK1 P23458 2/20 0.33
CCR2 P41597 1/20 0.32
EPHX2 P34913 1/20 0.31

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
SCHEMBL20682206 0.91 CCR2 (0.34) ATMNPC1DPP4JAK2JAK1
SCHEMBL20682201 0.84 DPP4 (0.36) ATMDPP4JAK2JAK1
SCHEMBL19014504 0.84 JAK1 (0.37) NPC1JAK2JAK1CCR2EPHX2
SCHEMBL19014058 0.81 EPHX2 (0.32) NPC1JAK2JAK1CCR2EPHX2
SCHEMBL20682393 0.80 CCR2 (0.38) NPC1JAK2JAK1CCR2
SCHEMBL22959671 0.78 ATM (0.38) ATMDPP4
SCHEMBL18806132 0.78 ATM (0.38) ATMDPP4
SCHEMBL20682320 0.78 CHRM2 (0.34) NPC1DPP4JAK1CCR2EPHX2
SCHEMBL20682222 0.78 JAK2 (0.35) ATMJAK2JAK1
SCHEMBL19014086 0.78 NPC1 (0.34) NPC1JAK1CCR2EPHX2

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-10189836-B2 Therapeutic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2019-01-29 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-10189836-B2 Therapeutic compounds, compositions and methods of use thereof JAK2, JAK1, JAK3 ATM 1612/4885NPC1 870/4885DPP4 1042/4885

“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.