SCHEMBL6368347

SCHEMBL6368347

NC(=O)C1CNc2c[c]ccc2O1

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AKR1B1 P15121 4/20 0.32
AKR1B10 O60218 1/20 0.32
AKR1A1 P14550 1/20 0.32
SIRT1 Q96EB6 2/20 0.31
CYSLTR1 Q9Y271 1/20 0.30

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
SCHEMBL1756750 0.78 HPGD (0.59) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL6374553 0.75 NISCH (0.45) HPGDCYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL3877557 0.74 AOC2 (0.38) HPGDSMN1; SMN2AKR1B1AKR1B10AKR1A1
Hydrochloric Acid SCHEMBL3872759 0.74
SCHEMBL24997390 0.73 ADAMTS5 (0.49) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL30054581 0.73 ADAMTS5 (0.49) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL24377994 0.73 HPGD (0.45) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL5803090 0.73 TSHR (0.35) KMT2ASMN1; SMN2SIRT1
SCHEMBL23552348 0.72 HSD17B10 (0.44) HPGDCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL3069893 0.72 NISCH (0.45) HPGDCYP2C19KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050020661-A1 Substituted 1H-indole-2- carboxamides and 6H-thieno(2,3-b)pyrrole-5-carboxamides useful for inhibiting glycogen phosphorylase in a mammal GAMMILL RONALD B (US) 2005-01-27 US claimed
US-20030199553-A1 Antidiabetic agents GAMMILL RONALD B (US) 2003-10-23 US claimed
WO-2003072570-A1 ANTIDIABETIC AGENTS PFIZER PRODUCTS INC. (US) 2003-09-04 WO claimed
EP-1340500-A1 Antidiabetic agents Pfizer Products Inc. (US) 2003-09-03 EP claimed
US-20050020661-A1 Substituted 1H-indole-2- carboxamides and 6H-thieno(2,3-b)pyrrole-5-carboxamides useful for inhibiting glycogen phosphorylase in a mammal GAMMILL RONALD B (US) 2005-01-27 US disclosed
US-6821977-B2 SUBSTITUTED 1H-(INDOLE-2- CARBOXAMIDES AND 6H-THIENO(2,3-B)PYRROLE-5-CARBOXAMIDES USEFUL FOR INHIBITING GLYCOGEN PHOSPHORYLASE IN A MAMMAL PFIZER, INC. 2004-11-23 US disclosed
US-20030199553-A1 Antidiabetic agents GAMMILL RONALD B (US) 2003-10-23 US disclosed
WO-2003072570-A1 ANTIDIABETIC AGENTS PFIZER PRODUCTS INC. (US) 2003-09-04 WO disclosed
EP-1340500-A1 Antidiabetic agents Pfizer Products Inc. (US) 2003-09-03 EP 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-20030199553-A1 Antidiabetic agents GPR119, IRS1, INSR HPGD 1956/4885CYP1A2 3402/4885CYP3A4 2851/4885
US-20050020661-A1 Substituted 1H-indole-2- carboxamides and 6H-thieno(2,3-b)pyrrole-5-carboxamides useful for inhibiting glycogen phosphorylase in a mammal PYGM, PYGL, IRS1 HPGD 2567/4885CYP1A2 2574/4885CYP3A4 2462/4885

“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.