SCHEMBL6284285

SCHEMBL6284285

CCOC(=O)c1c[nH]c2c(Cl)nc(C)cc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.62
▸ CYP3A4 P08684 1/20 0.62
▸ CYP2C19 P33261 1/20 0.62
▸ KMT2A Q03164 4/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ CLEC4M Q9H2X3 1/20 0.56
▸ GABRA1 P14867 3/20 0.51
▸ GABRB2 P47870 3/20 0.51
▸ KDM4E B2RXH2 5/20 0.50
▸ GABRB1 P18505 2/20 0.50
▸ GABRA3 P34903 2/20 0.50
▸ MAPT P10636 2/20 0.49
▸ ALDH1A1 P00352 4/20 0.44
▸ HPGD P15428 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TSHR P16473 1/20 0.40

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
SCHEMBL3421384 0.87 CYP1A2 (0.64) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL4300488 0.84 CYP1A2 (0.63) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL18984770 0.80 CLEC4M (0.63) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL7308147 0.80 CYP1A2 (0.76) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL11641095 0.79 CYP1A2 (0.63) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL11200159 0.78 CYP1A2 (0.62) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL5856135 0.76 KMT2A (0.61) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL17769503 0.75 CYP1A2 (0.56) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL11639094 0.75 CYP1A2 (0.70) CYP1A2CYP3A4CYP2C19KMT2AMEN1
SCHEMBL29376920 0.75 CYP1A2 (0.66) CYP1A2CYP3A4CYP2C19KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6903097-B2 Heterocycle carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY (US) 2005-06-07 — — US disclosed
US-20040142928-A1 Heterocycle carboxamides as antiviral agents BUNDY GORDON L (US) 2004-07-22 — — US disclosed
US-20030207880-A1 Heterocycle carboxamides as antiviral agents BUNDY GORDON L (US) 2003-11-06 — — US disclosed
US-6559145-B2 Herpes virus PHARMACIA & UPJOHN COMPANY 2003-05-06 — — US disclosed
EP-1301493-A2 HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-04-16 — — EP disclosed
US-20020025960-A1 Heterocycle carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2002-02-28 — — US disclosed
WO-2002004444-A2 HETEROCYCLE CARBOXAMIDES AS ANTIVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2002-01-17 — — 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 (3 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-20040142928-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 CYP1A2 1665/4885CYP3A4 851/4885CYP2C19 1019/4885
US-20020025960-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 CYP1A2 1665/4885CYP3A4 851/4885CYP2C19 1019/4885
US-20030207880-A1 Heterocycle carboxamides as antiviral agents ZC3HAV1, ZC3HAV1L, HDAC1 CYP1A2 1665/4885CYP3A4 851/4885CYP2C19 1019/4885

“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.

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