SCHEMBL22148690

SCHEMBL22148690

COC(=O)c1cc(NCc2cc(OC)cc(OC)c2)nc(N2CCC(F)(F)CC2)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
HRH1 P35367 1/20 0.40
HRH4 Q9H3N8 1/20 0.40
RET P07949 1/20 0.39
WHR1 P49842 5/20 0.39
KIF18A Q8NI77 7/20 0.38
RBP4 P02753 1/20 0.37
MAOB P27338 1/20 0.37
PIK3CA P42336 1/20 0.37
PIK3CB P42338 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
SCN9A Q15858 1/20 0.36

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
SCHEMBL22119456 0.84 P2RX3 (0.42) WHR1
SCHEMBL26646283 0.76 RBP4 (0.58) KCNQ3KCNQ2WHR1KIF18ARBP4
SCHEMBL30600681 0.76 RBP4 (0.58) KCNQ3KCNQ2WHR1KIF18ARBP4
SCHEMBL22119481 0.75 HIF1A (0.41) MAOBPIK3CAPIK3CB
SCHEMBL22119556 0.75 RBP4 (0.44) KCNQ3KCNQ2WHR1KIF18ARBP4
SCHEMBL22155678 0.73 KIF18A (0.68) KIF18A
SCHEMBL26744703 0.72 RBP4 (0.44) KCNQ3KCNQ2WHR1KIF18ARBP4
SCHEMBL28608216 0.71 TDP1 (0.45) KCNQ3KCNQ2HRH1HRH4RET
SCHEMBL30615839 0.69 RBP4 (0.54) KCNQ3KCNQ2RETKIF18ARBP4
SCHEMBL20746083 0.69 CRBN (0.59) KCNQ3KCNQ2KIF18ARBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236069-B2 KIF18A inhibitors AMGEN INC. (US) 2022-02-01 US disclosed
US-20200239441-A1 KIF18A INHIBITORS AMGEN INC. (US) 2020-07-30 US disclosed
WO-2020132648-A1 KIF18A INHIBITORS AMGEN INC. (US) 2020-06-25 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 (2 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-20200239441-A1 KIF18A INHIBITORS KIF18A, KIF18B, KIF15 KCNQ3 2199/4885KCNQ2 1733/4885HRH1 4265/4885
US-11236069-B2 KIF18A inhibitors KIF18A, KIF18B, KIF15 KCNQ3 2199/4885KCNQ2 1733/4885HRH1 4265/4885

“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.