SCHEMBL6733387

SCHEMBL6733387

CCOC(=O)c1cn2c3c(cc(CN4CCOCC4)cc3c1=O)NC(=O)C2

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 1/20 0.44
ALDH1A1 P00352 9/20 0.44
KDM4E B2RXH2 4/20 0.44
HSD17B10 Q99714 3/20 0.44
HPGD P15428 2/20 0.44
TSHR P16473 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
STAT3 P40763 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KCNH2 Q12809 2/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 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
SCHEMBL6620430 0.82 POLA1 (0.65) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6413852 0.80 ALDH1A1 (0.44) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6780896 0.79 ALDH1A1 (0.43) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6732348 0.78 POLA1 (0.71) POLA1ALDH1A1RAB9AKCNH2KMT2A
SCHEMBL6781920 0.75 ALDH1A1 (0.39) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6776971 0.74 ALDH1A1 (0.45) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6779854 0.73 CNR2 (0.47) POLA1ALDH1A1KDM4EHSD17B10HPGD
SCHEMBL6814201 0.73 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL7929460 0.72 ALDH1A1 (0.48) ALDH1A1KDM4EHSD17B10HPGDTSHR
SCHEMBL6728870 0.71 POLA1 (0.66) POLA1ALDH1A1TSHRRAB9AKCNH2

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-20040029879-A1 Heterocycle carboxamides as antiviral agents ANDERSON DAVID JOHN (US) 2004-02-12 US disclosed
US-6624159-B2 Herpes virus PHARMACIA & UPJOHN COMPANY 2003-09-23 US disclosed
US-6608082-B1 Treatment of erectile dysfunction using isoquinoline compound melanocortin receptor ligands LION BIOSCIENCE AG (DE) 2003-08-19 US disclosed
US-20020025959-A1 Heterocycle carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-28 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 (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-20040029879-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 POLA1 267/4885ALDH1A1 779/4885KDM4E 201/4885
US-20020025959-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 POLA1 267/4885ALDH1A1 779/4885KDM4E 201/4885

“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.