SCHEMBL5524611

SCHEMBL5524611

Cc1nnsc1NC(=O)Nc1ccc(-c2cc(-c3cnco3)ccc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ IMPDH2 P12268 8/20 0.50
▸ HTT P42858 2/20 0.45
▸ JAK3 P52333 1/20 0.43
▸ NPC1 O15118 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ PKM P14618 2/20 0.43
▸ P2RY1 P47900 1/20 0.42
▸ PTK2 Q05397 1/20 0.42
▸ RAB9A P51151 3/20 0.41
▸ IMPDH1 P20839 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ AAK1 Q2M2I8 1/20 0.38
▸ CSF1R P07333 1/20 0.37
▸ FLT1 P17948 1/20 0.37
▸ RPS6KB1 P23443 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
SCHEMBL5027354 0.90 IMPDH2 (0.52) KMT2AMEN1IMPDH2HTTJAK3
SCHEMBL5030844 0.84 KMT2A (0.38) KMT2AMEN1IMPDH2HTTKDM4E
SCHEMBL5534764 0.81 KDR (0.39) KMT2AMEN1HTTPKMLMNA
SCHEMBL5029740 0.79 PDGFRB (0.46) KMT2AMEN1HTTNPC1KDM4E
SCHEMBL5033825 0.75 IMPDH2 (0.44) KMT2AMEN1IMPDH2NPC1KDM4E
SCHEMBL5530853 0.74 MAPK14 (0.40) IMPDH2KDM4EALDH1A1CSF1RFLT1
SCHEMBL15942550 0.73 IL2 (0.47) KMT2AMEN1IMPDH2HTTNPC1
SCHEMBL5032059 0.73 IMPDH2 (0.66) KMT2AMEN1IMPDH2HTTJAK3
SCHEMBL8263207 0.73 IMPDH2 (0.48) IMPDH2NPC1KDM4EPKMRAB9A
SCHEMBL15214065 0.73 POLB (0.42) KMT2AMEN1HTTNPC1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8741960-B2 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2014-06-03 — — US claimed
US-20070249050-A1 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 — — US claimed
US-20140242120-A1 SUBSTITUTED AROMATIC COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-08-28 — — US disclosed
US-20140242120-A1 SUBSTITUTED AROMATIC COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-08-28 — — US disclosed
US-8741960-B2 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2014-06-03 — — US disclosed
US-8741960-B2 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2014-06-03 — — US disclosed
US-8741960-B2 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2014-06-03 — — US disclosed
US-20070249050-A1 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 — — US disclosed
US-20070249050-A1 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 — — US disclosed
US-20070249050-A1 Substituted aromatic compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2007-10-25 — — US disclosed
WO-2007087441-A2 SUBSTITUTED AROMATIC COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2007-08-02 — — WO 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-20070249050-A1 Substituted aromatic compounds for inflammation and immune-related uses CCR1, NLRP1, NLRP3 KMT2A 2335/4885MEN1 4217/4885IMPDH2 3907/4885
US-20140242120-A1 SUBSTITUTED AROMATIC COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CCR1, NLRP1, NLRP3 KMT2A 2335/4885MEN1 4217/4885IMPDH2 3907/4885

“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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