SCHEMBL2122152

SCHEMBL2122152

COc1cc(-c2[nH]c3c(C#N)cnn3c2Nc2cccc(CNC(=O)c3ccncc3)c2)cc(OC)c1OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ ROCK2 O75116 9/20 0.41
▸ ROCK1 Q13464 8/20 0.41
▸ CYP3A4 P08684 5/20 0.41
▸ CYP2C9 P11712 3/20 0.41
▸ PRKACA P17612 2/20 0.41
▸ PRKX P51817 2/20 0.41
▸ PRKCQ Q04759 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ GSK3A P49840 1/20 0.41
▸ GSK3B P49841 1/20 0.41
▸ CLK4 Q9HAZ1 1/20 0.41
▸ GRK5 P34947 1/20 0.40
▸ AURKA O14965 1/20 0.38
▸ MAPK14 Q16539 2/20 0.38
▸ NAMPT P43490 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ MAPT P10636 1/20 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
SCHEMBL2123560 0.93 AURKA (0.42) LMNAPOLBROCK2ROCK1CYP3A4
SCHEMBL2122690 0.92 LMNA (0.43) LMNAPOLBROCK2ROCK1CYP3A4
SCHEMBL2125128 0.89 KCNH2 (0.41) POLBROCK2ROCK1CYP3A4MEN1
SCHEMBL18686166 0.82 CSNK2A1 (0.45) LMNAGSK3BMAPT
SCHEMBL2124547 0.82 MAPT (0.42) LMNAPOLBMAPT
SCHEMBL2127298 0.81 LMNA (0.42) LMNAPOLBMEN1KMT2AMAPT
SCHEMBL2121694 0.81 KCNH2 (0.44) KMT2A
SCHEMBL2127740 0.81 ROCK2 (0.40) LMNAPOLBROCK2ROCK1NAMPT
SCHEMBL2125749 0.81 ROCK2 (0.40) LMNAROCK2ROCK1NAMPTKMT2A
SCHEMBL2126704 0.81 KDM4E (0.38) LMNAPOLBROCK2ROCK1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2443123-B1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS INC (US) 2017-04-05 — — EP claimed
US-8377945-B2 Small molecule inhibitors of spleen tyrosine kinase (SYK) RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 — — US claimed
EP-2443123-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) Rigel Pharmaceuticals, Inc. (US) 2012-04-25 — — EP claimed
WO-2010147898-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS, INC. (US) 2010-12-23 — — WO claimed
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) MIDCAP FINANCIAL TRUST 2010-12-16 — — US claimed
EP-2827890-B1 IMMUNOMODULATORY AGENT AND USES THEREFOR UNIV QUEENSLAND (AU) 2019-08-28 — — EP disclosed
EP-2443123-B1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS INC (US) 2017-04-05 — — EP disclosed
US-20150216955-A1 IMMUNOMODULATORY AGENT AND USES THEREFOR THE UNIVERSITY OF QUEENSLAND (AU) 2015-08-06 — — US disclosed
US-8377945-B2 Small molecule inhibitors of spleen tyrosine kinase (SYK) RIGEL PHARMACEUTICALS INC. (US) 2013-02-19 — — US disclosed
EP-2443123-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) Rigel Pharmaceuticals, Inc. (US) 2012-04-25 — — EP disclosed
WO-2010147898-A2 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) RIGEL PHARMACEUTICALS, INC. (US) 2010-12-23 — — WO disclosed
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) MIDCAP FINANCIAL TRUST 2010-12-16 — — 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-20150216955-A1 IMMUNOMODULATORY AGENT AND USES THEREFOR HLA-DRB1, CD74, CHI3L1 LMNA 4455/4885POLB 3981/4885ROCK2 1543/4885
US-20100316649-A1 SMALL MOLECULE INHIBITORS OF SPLEEN TYROSINE KINASE (SYK) SYK, BTK, LCK LMNA 4328/4885POLB 2525/4885ROCK2 334/4885

“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.

Send feedback