SCHEMBL6950271

SCHEMBL6950271

C=CCn1cncc1CO

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.44
CYP11B2 P19099 7/20 0.44
AVPR2 P30518 1/20 0.32
AVPR1A P37288 1/20 0.32
ADORA2B P29275 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL2053090 0.82 AVPR2 (0.32) AVPR2AVPR1AADORA2B
SCHEMBL859620 0.74
SCHEMBL27364397 0.74
SCHEMBL10926533 0.73 NPSR1 (0.43) CYP11B1CYP11B2
SCHEMBL9497797 0.72 ADORA2B (0.33) CYP11B1CYP11B2ADORA2B
SCHEMBL5779690 0.72
Iodide SCHEMBL27303018 0.72 CYP19A1 (0.41) CYP11B1CYP11B2ADORA2B
SCHEMBL5391398 0.71 CYP11B1 (0.45) CYP11B1CYP11B2ADORA2B
Hydrochloric Acid SCHEMBL9443719 0.71 ADORA2B (0.32) CYP11B1CYP11B2ADORA2B
SCHEMBL7247430 0.71 CYP11B1 (0.46) CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110039467-A1 Ionic liquid flame retardants H&C Chemical (US) 2011-02-17 US disclosed
US-6630593-B1 A process for preparing a 1-substituted 5-hydroxymethylimidazole of the formula: wherein R represents alkyl, hydroxyalkyl, allyl, or substituted or unsubstituted arylmethyl or diarylmethyl, comprising the step of reacting a LG CHEM INVESTMENT LTD. (KR) 2003-10-07 US disclosed
EP-1255737-A4 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG CHEM INVESTMENT LTD (KR) 2003-04-16 EP disclosed
EP-1255737-A1 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG Chem Investment, Ltd. (KR) 2002-11-13 EP disclosed
WO-2001017974-A1 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG CHEM INVESTMENT LTD. (KR) 2001-03-15 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 (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-20110039467-A1 Ionic liquid flame retardants L3MBTL4, AFF4, L3MBTL3 CYP11B1 2276/4885CYP11B2 2359/4885AVPR2 4395/4885

“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.