SCHEMBL19666435

SCHEMBL19666435

CC1(Nc2ncc(N)c(NC3CC(NC(=O)O)C3)n2)CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 3/20 0.45
▸ MAPK9 P45984 2/20 0.45
▸ MAPK1 P28482 6/20 0.34
▸ TYRO3 Q06418 2/20 0.33
▸ AXL P30530 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ MERTK Q12866 1/20 0.33
▸ GAS6 Q14393 1/20 0.33
▸ SYK P43405 5/20 0.33
▸ HDAC1 Q13547 3/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ MAPK3 P27361 1/20 0.32
▸ SELP P16109 1/20 0.32

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
SCHEMBL19666637 0.86 MAPK8 (0.43) MAPK8MAPK9MERTKSYK
SCHEMBL19666460 0.84 MAPK8 (0.40) MAPK8MAPK9MAPK1TYRO3AXL
SCHEMBL19666633 0.82 MAPK8 (0.41) MAPK8MAPK9MAPK1SYKHDAC1
SCHEMBL19666279 0.81 MAPK8 (0.49) MAPK8MAPK9SYKMAPK3
SCHEMBL29717674 0.81 MAPK8 (0.49) MAPK8MAPK9SYKMAPK3
SCHEMBL19666631 0.81 MAPK8 (0.49) MAPK8MAPK9SYKMAPK3
SCHEMBL19666278 0.81 MAPK8 (0.49) MAPK8MAPK9SYKMAPK3
SCHEMBL19666568 0.79 SYK (0.45) MAPK8MAPK9SYK
SCHEMBL19666569 0.79 SYK (0.45) MAPK8MAPK9SYK
SCHEMBL19666524 0.78 SYK (0.50) MAPK8MAPK9AXLMERTKSYK

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
US-10420772-B2 Animal and human anti-trypanosomonal and anti-leishmania agents CELGENE CORPORATION (US) 2019-09-24 — — US disclosed
EP-3464312-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS Celgene Corporation (US) 2019-04-10 — — EP disclosed
US-20180280399-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS CELGENE CORP (US) 2018-10-04 — — US disclosed
US-10010555-B2 Animal and human anti-trypanosomonal and anti-leishmania agents CELGENE CORPORATION (US) 2018-07-03 — — US disclosed
US-20170348315-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS CELGENE CORPORATION 2017-12-07 — — US disclosed
WO-2017210408-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS CELGENE CORPORATION (US) 2017-12-07 — — 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 (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-20180280399-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS TPMT, TYMP, ATIC MAPK8 1870/4885MAPK9 2986/4885MAPK1 811/4885
US-10010555-B2 Animal and human anti-trypanosomonal and anti-leishmania agents TPMT, TYMP, ATIC MAPK8 1870/4885MAPK9 2986/4885MAPK1 811/4885
US-10420772-B2 Animal and human anti-trypanosomonal and anti-leishmania agents TPMT, TYMP, ATIC MAPK8 1870/4885MAPK9 2986/4885MAPK1 811/4885
US-20170348315-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS TPMT, TYMP, ATIC MAPK8 1870/4885MAPK9 2986/4885MAPK1 811/4885

“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.

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