SCHEMBL4829307

SCHEMBL4829307

Cn1cc(-c2ccc(F)cc2)c(CO)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 9/20 0.54
CSNK1E P49674 6/20 0.54
MAPK14 Q16539 5/20 0.54
MAPK11 Q15759 4/20 0.54
MAPK13 O15264 2/20 0.54
MAPK12 P53778 2/20 0.54
MAP4K4 O95819 2/20 0.44
MAPK9 P45984 2/20 0.44
CSNK1A1 P48729 2/20 0.44
EGFR P00533 1/20 0.44
FRK P42685 1/20 0.44
RAB9A P51151 1/20 0.42
KCNH2 Q12809 1/20 0.42
SCN4A P35499 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 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
SCHEMBL12871637 0.86 CSNK1D (0.54) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL22310228 0.85 CSNK1D (0.56) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL22309916 0.85 CSNK1D (0.53) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL25731619 0.82 RAB9A (0.51) CSNK1DCSNK1ERAB9AALDH1A1MEN1
SCHEMBL8101088 0.81 CSNK1D (0.51) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL4286489 0.77 CSNK1D (0.58) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL20972098 0.75 IDO1 (0.57) CSNK1DCSNK1EALDH1A1CYP1A2GAA
SCHEMBL15478684 0.75 CSNK1D (0.57) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL17610305 0.75 CSNK1D (0.57) CSNK1DCSNK1EMAPK14MAPK11MAPK13
SCHEMBL12859266 0.74 CSNK1D (0.55) CSNK1DCSNK1EMAPK14MAPK11MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210387968-A1 HETEROARYLMETHYLENE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES INC (US) 2021-12-16 US disclosed
WO-2020160213-A1 HETEROARYLMETHYLENE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS IDEAYA BIOSCIENCES, INC. (US) 2020-08-06 WO disclosed
US-20080287438-A1 Agent for preventing or treating neuropathy MOMOSE YU 2008-11-20 US disclosed
US-7423159-B2 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-09-09 US disclosed
US-20060004069-A1 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 US disclosed
EP-1556032-A1 AGENT FOR PREVENTING OR TREATING NEUROPATHY Takeda Pharmaceutical Company Limited (JP) 2005-07-27 EP disclosed
WO-2004039365-A1 AGENT FOR PREVENTING OR TREATING NEUROPATHY TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 WO 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 (3 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-20060004069-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 CSNK1D 2708/4885CSNK1E 2860/4885MAPK14 1479/4885
US-20080287438-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 CSNK1D 2708/4885CSNK1E 2860/4885MAPK14 1479/4885
US-20210387968-A1 HETEROARYLMETHYLENE DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS POLQ, POLH, POLB CSNK1D 229/4885CSNK1E 209/4885MAPK14 2386/4885

“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.