SCHEMBL2608586

SCHEMBL2608586

Cc1cncc(-c2nc3cnccc3c(Cl)c2C)c1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 5/20 0.42
RORC P51449 1/20 0.40
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
PTGS2 P35354 1/20 0.36
LATS1 O95835 7/20 0.35
KDM4C Q9H3R0 1/20 0.35
CYP2A6 P11509 2/20 0.35
LATS2 Q9NRM7 4/20 0.35
PIK3CA P42336 1/20 0.35
ACHE P22303 1/20 0.34

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
SCHEMBL2124665 0.86 KDM4C (0.50) DHODHRORCCYP11B1CYP11B2KDM4C
SCHEMBL2126711 0.81 PIK3CA (0.43) DHODHRORCLATS1KDM4CPIK3CA
SCHEMBL2124508 0.77 PIK3CA (0.46) DHODHLATS1CYP2A6LATS2PIK3CA
SCHEMBL2123197 0.74 RORC (0.43) DHODHRORCLATS1KDM4CLATS2
SCHEMBL2124649 0.72 KDM4E (0.49) DHODHCYP2A6PIK3CA
SCHEMBL2712930 0.71 CYP11B1 (0.44) DHODHCYP11B1CYP11B2ACHE
SCHEMBL2125276 0.70 PIK3CA (0.45) CYP11B1CYP11B2PTGS2CYP2A6PIK3CA
SCHEMBL2124769 0.69 DHODH (0.50) DHODHRORCCYP11B1CYP11B2PIK3CA
SCHEMBL2711571 0.69 DHODH (0.46) DHODHRORCCYP11B1CYP11B2
SCHEMBL2123766 0.68 MAPK14 (0.52) DHODHPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-8765940-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2014-07-01 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 US disclosed
US-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2012-04-19 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 (1 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-20120094972-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, MALT1, BCL9 DHODH 2656/4885RORC 192/4885CYP11B1 1284/4885

“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.