SCHEMBL19928567

SCHEMBL19928567

CS(C)(C)CCOCn1ccc2c(-c3cn[nH]c3)ncnc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.39
PRMT5 O14744 1/20 0.35
SCN9A Q15858 1/20 0.32
TPH1 P17752 1/20 0.31
PIK3CG P48736 1/20 0.31
PIM1 P11309 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 0.30

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
SCHEMBL31089960 0.86 SIGMAR1 (0.40) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL99142 0.86 SIGMAR1 (0.40) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL21201777 0.85 SIGMAR1 (0.39) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL17539275 0.85 SIGMAR1 (0.39) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL17387449 0.84 SIGMAR1 (0.39) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL19790077 0.83 SIGMAR1 (0.42) SIGMAR1PRMT5SCN9ATPH1
SCHEMBL18638756 0.83 AURKA (0.40)
SCHEMBL19059356 0.82 SIGMAR1 (0.40) SIGMAR1PRMT5SCN9ATPH1PIK3CG
SCHEMBL19304149 0.81 GRK2 (0.32)
SCHEMBL13286173 0.80 SIGMAR1 (0.46) SIGMAR1PRMT5SCN9ATPH1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172863-A1 MODIFIED-RELEASE DOSAGE FORMS OF RUXOLITINIB ARBOR PHARMACEUTICALS, LLC 2023-06-08 US disclosed
US-20210253584-A1 Processes for Preparing Jak Inhibitors and Related Intermediate Compounds INCYTE HOLDINGS CORPORATION 2021-08-19 US disclosed
US-10975085-B2 Process for preparing a composition comprising an enantiomeric excess of greater than or equal to 90% of the (R)-enantiomer of a compound of formula III INCYTE HOLDINGS CORPORATION (US) 2021-04-13 US disclosed
EP-3771716-A1 LOW HYGROSCOPIC AMORPHOUS FORM OF BARICITINIB Zaklady Farmaceutyczne "Polpharma" S.A. (PL) 2021-02-03 EP disclosed
US-9908888-B2 Processes for preparing pyrazolyl-substituted pyrrolo[2,3-d]pyrimidines INCYTE CORPORATION (US) 2018-03-06 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 (3 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-10975085-B2 Process for preparing a composition comprising an enantiomeric excess of greater than or equal to 90% of the (R)-enantiomer of a compound of formula III JAK1, JAK3, JAK2 SIGMAR1 2072/4885PRMT5 433/4885SCN9A 4060/4885
US-20230172863-A1 MODIFIED-RELEASE DOSAGE FORMS OF RUXOLITINIB JAK1, JAK3, JAK2 SIGMAR1 2728/4885PRMT5 248/4885SCN9A 4195/4885
US-20210253584-A1 Processes for Preparing Jak Inhibitors and Related Intermediate Compounds JAK3, JAK1, JAK2 SIGMAR1 3460/4885PRMT5 656/4885SCN9A 3332/4885

“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.