SCHEMBL7067699

SCHEMBL7067699

Cc1nc(N2CCOCC2)ccc1-c1ccc(NC(=O)Nc2ccc(C#N)cc2)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.47
PIK3CA P42336 8/20 0.46
MTOR P42345 8/20 0.46
PIK3CG P48736 3/20 0.46
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
KMT2A Q03164 1/20 0.45
PIK3R1 P27986 4/20 0.43
HIF1A Q16665 1/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PIK3CD O00329 1/20 0.42
PIK3CB P42338 1/20 0.42
EGLN1 Q9GZT9 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL4464429 0.90 PIK3CA (0.52) PIK3CAMTORPIK3CGKDM4EMEN1
SCHEMBL7069390 0.83 EPHX2 (0.49) KDM4EMAPTALDH1A1CLK2GSK3A
SCHEMBL4456006 0.80 MAPK1 (0.42) PIK3CAMTORPIK3CGKDM4EMEN1
SCHEMBL7189256 0.80 RAF1 (0.54) KDM4ECLK2GSK3AGSK3BCSNK2A1
SCHEMBL7064948 0.79 KDM4E (0.45) PIK3CAMTORPIK3CGKDM4EMEN1
SCHEMBL6257285 0.79 MTOR (0.41) PIK3CAMTORPIK3CGKDM4EMEN1
SCHEMBL5462710 0.78 PIK3CA (0.40) PIK3CAMTORPIK3CGKDM4EMEN1
SCHEMBL7070212 0.77 MAPK14 (0.49) PIK3CAKDM4EMEN1USP2KMT2A
SCHEMBL28747223 0.75 CLK2 (0.49) KDM4EMEN1USP2KMT2ACLK2
SCHEMBL27559838 0.75 MAPK14 (0.54) KDM4EKMT2AMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030220336-A1 Method of treating mucus hypersecretion BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-11-27 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 (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-20030220336-A1 Method of treating mucus hypersecretion MUC1, CFTR, MAPKAPK5 CNR1 776/4885PIK3CA 368/4885MTOR 1204/4885

“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.