SCHEMBL23735690

SCHEMBL23735690

CC(C)CC1CCCC(N)CCC1

nearest known ligand 0.48

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.34

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
SCHEMBL170562 0.87
SCHEMBL3682172 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL19079580 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL21703658 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL20118074 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL19079578 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL19079575 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL19079579 0.86 ANPEP (0.32) MMP8MMP1
SCHEMBL102088 0.85 CPB2 (0.33) MMP8MMP1
SCHEMBL105388 0.85 CPB2 (0.33) MMP8MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4001269-A1 BENZOISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER Amgen Inc. (US) 2022-05-25 EP disclosed
EP-3558955-B1 BENZISOTHIAZOLE, ISOTHIAZOLO[3,4-B]PYRIDINE, QUINAZOLINE, PHTHALAZINE, PYRIDO[2,3-D]PYRIDAZINE AND PYRIDO[2,3-D]PYRIMIDINE DERIVATIVES AS KRAS G12C INHIBITORS FOR TREATING LUNG, PANCREATIC OR COLORECTAL CANCER AMGEN INC (US) 2021-08-11 EP disclosed