SCHEMBL19666517

SCHEMBL19666517

CC1(Nc2ncc(N)c(NC3CCC(C(=O)N4CCCCC4)CC3)n2)CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 10/20 0.47
▸ MAPK8 P45983 3/20 0.43
▸ MAPK9 P45984 3/20 0.43
▸ MAPK10 P53779 3/20 0.41
▸ JUN P05412 1/20 0.41
▸ BTK Q06187 1/20 0.39
▸ CCNE1 P24864 3/20 0.38
▸ CDK2 P24941 3/20 0.38
▸ TTK P33981 1/20 0.37
▸ PIK3R1 P27986 2/20 0.37
▸ PIK3CA P42336 2/20 0.37

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
SCHEMBL19666518 1.00 SYK (0.47) SYKMAPK8MAPK9MAPK10JUN
SCHEMBL19666524 0.94 SYK (0.50) SYKMAPK8MAPK9MAPK10BTK
SCHEMBL19666526 0.94 SYK (0.50) SYKMAPK8MAPK9MAPK10BTK
SCHEMBL29717674 0.86 MAPK8 (0.49) SYKMAPK8MAPK9
SCHEMBL19666279 0.86 MAPK8 (0.49) SYKMAPK8MAPK9
SCHEMBL19666631 0.86 MAPK8 (0.49) SYKMAPK8MAPK9
SCHEMBL19666278 0.86 MAPK8 (0.49) SYKMAPK8MAPK9
SCHEMBL19666589 0.86 SYK (0.43) SYKMAPK8MAPK9MAPK10JUN
SCHEMBL19666587 0.86 SYK (0.43) SYKMAPK8MAPK9MAPK10JUN
SCHEMBL19666569 0.84 SYK (0.45) SYKMAPK8MAPK9BTK

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
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

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-10010555-B2 Animal and human anti-trypanosomonal and anti-leishmania agents TPMT, TYMP, ATIC SYK 4069/4885MAPK8 1870/4885MAPK9 2986/4885
US-20170348315-A1 ANIMAL AND HUMAN ANTI-TRYPANOSOMONAL AND ANTI-LEISHMANIA AGENTS TPMT, TYMP, ATIC SYK 4069/4885MAPK8 1870/4885MAPK9 2986/4885

“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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