SCHEMBL31713883

SCHEMBL31713883

CCc1cc(=O)n2nc(C3=CCOCC3)nc2n1CC(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.38
▸ PIK3CA P42336 3/20 0.37
▸ PIK3CD O00329 2/20 0.37
▸ MAPT P10636 5/20 0.36
▸ MTOR P42345 2/20 0.35
▸ LMNA P02545 3/20 0.35
▸ GPBAR1 Q8TDU6 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ PTGER4 P35408 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ AKR1B1 P15121 1/20 0.34
▸ PIK3CB P42338 1/20 0.33

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
SCHEMBL30038447 0.89 WRN (0.61) WRNKDM4EPIK3CDMAPTPOLB
SCHEMBL25036852 0.89 WRN (0.61) WRNKDM4EPIK3CDMAPTPOLB
SCHEMBL25035302 0.87 WRN (0.44) WRNKDM4EPIK3CAMAPTMTOR
SCHEMBL31713788 0.85 WRN (0.55) WRNKDM4EPIK3CAPIK3CDMAPT
SCHEMBL31295793 0.85 WRN (0.57) WRNKDM4EMAPTPOLBHSD17B10
SCHEMBL30984113 0.84 WRN (0.47) WRNPIK3CAPIK3CDMAPTMTOR
SCHEMBL30984247 0.83 WRN (0.49) WRNKDM4EPIK3CDMAPTLMNA
SCHEMBL30984318 0.83 WRN (0.45) WRNPIK3CAPIK3CDMAPTPOLB
SCHEMBL30984280 0.82 WRN (0.49) WRNPIK3CAPIK3CDMAPTLMNA
SCHEMBL30984191 0.82 WRN (0.49) WRNPIK3CDMAPTPOLBTP53

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-20250333419-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF WRN INCYTE CORPORATION (US) 2025-10-30 — — 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-20250333419-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF WRN WRN, BLM, RECQL WRN 1/4885KDM4E 3651/4885PIK3CA 2236/4885

“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.

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