SCHEMBL17664672

SCHEMBL17664672

CN1CCOc2cc(C3CC3)cc(F)c2C1=O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTK Q06187 19/20 0.39
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
PKLR P30613 1/20 0.36
RAB9A P51151 1/20 0.36
BMX P51813 2/20 0.35

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
SCHEMBL17663684 0.83 BTK (0.42) BTKBMX
SCHEMBL17660264 0.83 BTK (0.36) BTKBMX
SCHEMBL21207713 0.81 BTK (0.35) BTKBMX
SCHEMBL17660281 0.80 PRMT5 (0.42) BTK
SCHEMBL17664671 0.76 MEN1 (0.37) BTK
SCHEMBL1775926 0.73 LRRK2 (0.42) NPC1PKMPKLRRAB9A
SCHEMBL17645688 0.73 BTK (0.43) BTKBMX
SCHEMBL17645911 0.73 BTK (0.43) BTK
SCHEMBL16546188 0.72 BTK (0.50) BTKBMX
SCHEMBL17660321 0.72 BTK (0.44) BTKBMX

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
EP-3204382-B1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2021-12-01 EP disclosed
WO-2016057500-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-04-14 WO disclosed
US-20160096834-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-04-07 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-20160096834-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF BTK, SYK, LYN BTK 1/4885NPC1 3990/4885PKM 2865/4885

“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.