SCHEMBL6791196

SCHEMBL6791196

COC(=O)c1[nH]nc2c1CC(C)c1cc(OC)ccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
ALPL P05186 2/20 0.50
HSD17B10 Q99714 2/20 0.50
ATM Q13315 1/20 0.50
CLK1 P49759 1/20 0.50
TP53 P04637 1/20 0.45
MAPT P10636 5/20 0.39
LMNA P02545 3/20 0.39
POLB P06746 2/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 3/20 0.38
HPGD P15428 3/20 0.38
HSP90AA1 P07900 6/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 3/20 0.38
CYP1A2 P05177 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
SCHEMBL6788509 0.87 MEN1 (0.39) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6795251 0.79 MEN1 (0.63) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6792055 0.78 KDM4E (0.80) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6797438 0.77 MEN1 (0.53) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6795133 0.76 MEN1 (0.54) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6792195 0.74 MEN1 (0.46) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6792442 0.69 KDM4E (0.54) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6800381 0.68 KDM4E (0.54) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6787223 0.68 MEN1 (0.80) KDM4EMEN1KMT2ANPC1RAB9A
SCHEMBL6799356 0.68 CHEK1 (0.48) KDM4EMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 US claimed
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 KDM4E 2167/4885MEN1 1382/4885KMT2A 1257/4885

“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.