SCHEMBL16670692

SCHEMBL16670692

CC(C)(C)OC(=O)N1CCC(c2ncc(C(N)=O)c(Oc3ccc(Oc4ccccc4)cc3)n2)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 3/20 0.46
BTK Q06187 9/20 0.45
PDE10A Q9Y233 1/20 0.43
JAK2 O60674 3/20 0.43
JAK1 P23458 3/20 0.43
TNK2 Q07912 1/20 0.42
USP30 Q70CQ3 1/20 0.42
EGFR P00533 1/20 0.42
TEC P42680 1/20 0.42
PARP1 P09874 1/20 0.42

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
SCHEMBL16597710 0.90 BTK (0.51) HPGDSBTKTNK2USP30EGFR
SCHEMBL28881584 0.85 BTK (0.51) HPGDSBTKPDE10AEGFRTEC
SCHEMBL16597606 0.84 BTK (0.53) HPGDSBTKTNK2EGFRTEC
SCHEMBL16670535 0.84 BTK (0.64) BTKEGFRTEC
SCHEMBL16670316 0.82 BTK (0.49) BTKJAK1USP30EGFRPARP1
SCHEMBL16670321 0.80 BTK (0.47) HPGDSBTKPDE10ATNK2
SCHEMBL16670612 0.80 BTK (0.62) BTKEGFRTEC
SCHEMBL16670425 0.80 PTPN11 (0.59) BTKPARP1
SCHEMBL16597588 0.79 BTK (0.66) BTKTNK2EGFRTEC
SCHEMBL16669957 0.77 BTK (0.51) BTKJAK2JAK1USP30PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10329270-B2 Heteroaryl compounds as BTK inhibitors and uses thereof MERCK PATENT GMBH (DE) 2019-06-25 US disclosed
US-10329270-B2 Heteroaryl compounds as BTK inhibitors and uses thereof MERCK PATENT GMBH (DE) 2019-06-25 US disclosed
EP-3060550-B1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-05-15 EP disclosed
EP-3060550-B1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2019-05-15 EP disclosed
US-20160264548-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-09-15 US disclosed
US-20160264548-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-09-15 US disclosed
US-20160264548-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2016-09-15 US disclosed
EP-3060550-A2 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF Merck Patent GmbH (DE) 2016-08-31 EP disclosed
WO-2015061247-A2 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2015-04-30 WO disclosed
WO-2015061247-A2 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF MERCK PATENT GMBH (DE) 2015-04-30 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-20160264548-A1 HETEROARYL COMPOUNDS AS BTK INHIBITORS AND USES THEREOF BTK, SYK, LCK HPGDS 1112/4885BTK 1/4885PDE10A 1674/4885
US-10329270-B2 Heteroaryl compounds as BTK inhibitors and uses thereof BTK, SYK, LCK HPGDS 1112/4885BTK 1/4885PDE10A 1674/4885

“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.