SCHEMBL20187148

SCHEMBL20187148

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)N(c1ccc(Cl)cc1F)CN2c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 9/20 0.59
NPC1L1 Q9UHC9 2/20 0.49
USP30 Q70CQ3 1/20 0.45
HRH3 Q9Y5N1 4/20 0.45
CCR5 P51681 2/20 0.44
ENPP2 Q13822 1/20 0.42
MAPK8 P45983 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
SCHEMBL20187161 0.90 DDR1 (0.59) DDR1NPC1L1USP30HRH3CCR5
SCHEMBL20187038 0.88 DDR1 (0.60) DDR1NPC1L1USP30HRH3CCR5
SCHEMBL20187028 0.88 DDR1 (0.61) DDR1NPC1L1USP30HRH3CCR5
SCHEMBL20187112 0.87 DDR1 (0.55) DDR1NPC1L1USP30CCR5ENPP2
SCHEMBL319067 0.79 NPC1L1 (0.55) DDR1NPC1L1USP30CCR5
SCHEMBL20187089 0.78 DDR1 (0.58) DDR1HRH3ENPP2
SCHEMBL17140692 0.78 NPC1L1 (0.58) NPC1L1USP30CCR5ENPP2
SCHEMBL7845129 0.78 NPC1L1 (0.58) DDR1NPC1L1USP30CCR5
SCHEMBL17140752 0.78 NPC1L1 (0.48) DDR1NPC1L1USP30CCR5ENPP2
SCHEMBL12338068 0.78 OPRM1 (0.59) DDR1NPC1L1USP30CCR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107849044-B Triaza-spirodecanones as DDR1 inhibitors 豪夫迈·罗氏有限公司 2021-06-25 CN disclosed
EP-3317279-B1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS HOFFMANN LA ROCHE (CH) 2021-01-27 EP disclosed
US-10435407-B2 Triaza-spirodecanones as DDR1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2019-10-08 US disclosed
US-20190169189-A1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2019-06-06 US disclosed
US-10239876-B2 Triaza-spirodecanones as DDR1 inhibitors HOFFMAN LA-ROCHE INC. (US) 2019-03-26 US disclosed
US-20180148450-A1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS HOFFMANN LA-ROCHE INC. (US) 2018-05-31 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-20190169189-A1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS DDR1, DDR2, DDRGK1 DDR1 1/4885NPC1L1 3430/4885USP30 3051/4885
US-20180148450-A1 TRIAZA-SPIRODECANONES AS DDR1 INHIBITORS DDR1, DDR2, DDRGK1 DDR1 1/4885NPC1L1 3430/4885USP30 3051/4885
US-10435407-B2 Triaza-spirodecanones as DDR1 inhibitors DDR1, DDR2, DDRGK1 DDR1 1/4885NPC1L1 3430/4885USP30 3051/4885
US-10239876-B2 Triaza-spirodecanones as DDR1 inhibitors DDR1, DDR2, DDRGK1 DDR1 1/4885NPC1L1 3430/4885USP30 3051/4885

“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.