SCHEMBL21180509

SCHEMBL21180509

CC(C)(C)c1noc(C(F)F)n1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.35
CNR2 P34972 1/20 0.32
IDH1 O75874 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
SCHEMBL23490727 0.83 PIK3CG (0.33) PIK3CGCNR2IDH1
SCHEMBL2605502 0.80 HTT (0.38) PIK3CGIDH1
SCHEMBL20049385 0.77 PIK3CG (0.34) PIK3CGIDH1
SCHEMBL9449998 0.77 PIK3CG (0.34) PIK3CGIDH1
SCHEMBL10147793 0.77 PIK3CG (0.34) PIK3CGIDH1
SCHEMBL14213299 0.74 PIK3CG (0.33) PIK3CGIDH1
SCHEMBL20049229 0.72 PIK3CG (0.32) PIK3CGIDH1
SCHEMBL24704040 0.72 PIK3CG (0.32) PIK3CGIDH1
SCHEMBL21180510 0.71
SCHEMBL2306407 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11661418-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-05-30 US disclosed
US-20210171512-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2021-06-10 US disclosed
US-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS HOLDINGS, LLC 2020-06-04 US disclosed
US-10357493-B2 Metalloenzyme inhibitor compounds SELENITY THERAPEUTICS (BERMUDA), LTD. (BM) 2019-07-23 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 (4 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-20200171028-A1 METALLOENZYME INHIBITOR COMPOUNDS HDAC6, HDAC1, HDAC2 PIK3CG 4543/4885CNR2 4871/4885IDH1 451/4885
US-20210171512-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 PIK3CG 2251/4885CNR2 4647/4885IDH1 2872/4885
US-10357493-B2 Metalloenzyme inhibitor compounds HDAC6, HDAC1, HDAC2 PIK3CG 4543/4885CNR2 4871/4885IDH1 451/4885
US-11661418-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 PIK3CG 2251/4885CNR2 4647/4885IDH1 2872/4885

“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.