SCHEMBL4336930

SCHEMBL4336930

O=C(O)Nc1cccc(CNC(=O)c2cccc(Nc3nc(Cl)ncc3Cl)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
BRD4 O60885 1/20 0.46
PPARG P37231 2/20 0.46
MAPK1 P28482 1/20 0.45
SENP1 Q9P0U3 5/20 0.45
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
AURKA O14965 1/20 0.43
RPS6KB1 P23443 1/20 0.43
AURKB Q96GD4 1/20 0.43
ROCK1 Q13464 1/20 0.43
NTRK1 P04629 2/20 0.43
EGFR P00533 1/20 0.43
BTK Q06187 1/20 0.43
SENP2 Q9HC62 1/20 0.43

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
SCHEMBL1026333 0.88 AURKA (0.47) LMNAMAPTSMN1; SMN2BRD4SENP1
SCHEMBL1026707 0.87 MEN1 (0.49) EGFRMEN1KMT2A
SCHEMBL13623006 0.86 MET (0.47) BRD4PPARGSENP1AURKARPS6KB1
SCHEMBL1082504 0.86 JAK3 (0.48) NTRK1EGFRBTK
SCHEMBL1028245 0.84 PPARG (0.41) LMNAMAPTSMN1; SMN2BRD4PPARG
SCHEMBL1026266 0.84 ALDH1A1 (0.52) LMNAMAPTSMN1; SMN2SENP1HPGD
SCHEMBL4364555 0.83 JAK3 (0.43) MAPTEGFRBTKNPC1KMT2A
SCHEMBL4335022 0.83 BTK (0.42) EGFRBTKNPC1KMT2A
SCHEMBL3007786 0.82 JAK3 (0.54) AURKANTRK1
SCHEMBL4334439 0.82 KMT2A (0.46) LMNAMAPTALDH1A1SIRT2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 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 (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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK LMNA 4393/4885MAPT 3239/4885SMN1; SMN2 4274/4885

“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.