SCHEMBL13321606

SCHEMBL13321606

COC(=O)c1cc(NC(=O)c2c(F)cccc2F)ccc1-c1cc(-c2cccnc2)sc1CO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.42
▸ DYRK1A Q13627 3/20 0.41
▸ DYRK1B Q9Y463 1/20 0.41
▸ IL2 P60568 2/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ RAB9A P51151 1/20 0.39
▸ CYP11B1 P15538 1/20 0.39
▸ CYP11B2 P19099 1/20 0.39
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39
▸ CCNA2 P20248 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT1 Q96EB6 1/20 0.39
▸ SIRT3 Q9NTG7 1/20 0.39
▸ BRAF P15056 1/20 0.39
▸ NPY2R P49146 1/20 0.39
▸ PSMD14 O00487 1/20 0.39
▸ CFTR P13569 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
SCHEMBL7928883 0.92 LMNA (0.47) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL13321607 0.86 LMNA (0.45) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL13640661 0.78 LMNA (0.47) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL2894859 0.77 LMNA (0.55) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL2315507 0.76 LMNA (0.56) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL7917075 0.75 LMNA (0.52) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL2315494 0.75 LMNA (0.52) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL2315252 0.74 LMNA (0.51) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL2886943 0.71 LMNA (0.55) LMNAMAPTDYRK1ADYRK1BIL2
SCHEMBL1641874 0.70 RAB9A (0.62) LMNAMAPTIL2RAB9AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 — — US disclosed
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 — — US disclosed
US-20130165451-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2013-06-27 — — US disclosed
US-8314130-B2 Compounds inclunding substituted pyridines for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 — — US disclosed
US-8314130-B2 Compounds inclunding substituted pyridines for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2012-11-20 — — US disclosed
US-20120283272-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2012-11-08 — — US disclosed
US-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-05-27 — — US disclosed
US-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2010-05-27 — — 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-20100130510-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 LMNA 4757/4885MAPT 1028/4885DYRK1A 4239/4885
US-20120283272-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 LMNA 4757/4885MAPT 1028/4885DYRK1A 4239/4885
US-20130165451-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 LMNA 4757/4885MAPT 1028/4885DYRK1A 4239/4885
US-20140107132-A1 SUBSTITUTED PYRIDINE COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES NLRP3, NLRP1, NOD1 LMNA 4667/4885MAPT 1185/4885DYRK1A 2931/4885

“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