SCHEMBL10239074

SCHEMBL10239074

Cc1ccc2c(n1)NC(=O)C(C)(C)O2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 4/20 0.41
KDM4E B2RXH2 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
BMPR1B O00238 1/20 0.38
CDC7 O00311 1/20 0.38
PIK3CD O00329 1/20 0.38
PLK4 O00444 1/20 0.38
STK25 O00506 1/20 0.38
CIT O14578 1/20 0.38
RIOK3 O14730 1/20 0.38
CHEK1 O14757 1/20 0.38
IKBKB O14920 1/20 0.38
AURKA O14965 1/20 0.38
GAK O14976 1/20 0.38
CHUK O15111 1/20 0.38
MUSK O15146 1/20 0.38
EPHB6 O15197 1/20 0.38
MAPK13 O15264 1/20 0.38
PDPK1 O15530 1/20 0.38

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
SCHEMBL12554421 0.81 NPC1 (0.34) SYKBMPR1BCDC7PIK3CDPLK4
SCHEMBL12654383 0.81 SYK (0.41) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL29671172 0.81 SYK (0.41) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL22096128 0.81 SYK (0.41) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL22192 0.81 SYK (0.41) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL24156807 0.81 SYK (0.41) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL5946341 0.79 SYK (0.39) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL10187826 0.79 SYK (0.39) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL14235384 0.79 SYK (0.49) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B
SCHEMBL15979058 0.79 SYK (0.47) SYKKDM4ESMN1; SMN2ALDH1A1BMPR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021259208-A1 TYK-2 INHIBITOR BEIGENE, LTD. (KY) 2021-12-30 WO disclosed
WO-2017137743-A1 ANTIBACTERIAL COMPOUNDS REDX PHARMA PLC (GB) 2017-08-17 WO disclosed
WO-2017137744-A1 HETEROCYCLIC COMPOUNDS, IN PARTICULAR 2-OXO-4,4,5,5,6,6,7,7-OCTAHYDROBENZOXAZOLE DERIVATIVES, AND THEIR USE AS ANTIBACTERIAL COMPOUNDS REDX PHARMA PLC (GB) 2017-08-17 WO disclosed
EP-2252300-B1 USE OF 2,4-PYRIMIDINEDIAMINES FOR THE TREATMENT OF ATHEROSCLEROSIS RIGEL PHARMACEUTICALS INC (US) 2016-10-19 EP disclosed
US-9040543-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2015-05-26 US disclosed
US-20140234333-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2014-08-21 US disclosed
US-8729087-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2014-05-20 US disclosed
US-8546370-B2 Compounds and compositions as kinase inhibitors IRM LLC (BM) 2013-10-01 US disclosed
US-8530466-B2 Use of 2,4-pyrimidinediamines for the treatment of atherosclerosis RIGEL PHARMACEUTICALS, INC. (US) 2013-09-10 US disclosed
US-20120213795-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2012-08-23 US disclosed
US-8193197-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-06-05 US disclosed
US-20110144330-A1 2,4-Pyrimidinediamine Compounds and their Uses RIGEL PHARMACEUTICALS, INC. (US) 2011-06-16 US disclosed
WO-2009097287-A1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-08-06 WO disclosed
US-20080194603-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-08-14 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-20140234333-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK2, JAK1, JAK3 SYK 42/4885KDM4E 1615/4885SMN1; SMN2 2525/4885
US-20120213795-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK2, JAK1, JAK3 SYK 42/4885KDM4E 1615/4885SMN1; SMN2 2525/4885
US-20080194603-A1 Prevent transplant rejection; autoimmune diseases JAK1, JAK3, JAK2 SYK 162/4885KDM4E 1600/4885SMN1; SMN2 4767/4885
US-20110144330-A1 2,4-Pyrimidinediamine Compounds and their Uses FCER2, FCGR1A, FCGR2A SYK 54/4885KDM4E 2840/4885SMN1; SMN2 4764/4885

“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.