SCHEMBL7698170

SCHEMBL7698170

CCCCCC1=NC(CCCCC)CN1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 8/20 0.36
NOS2 P35228 8/20 0.36
NOS3 P29474 3/20 0.35
SCN2A Q99250 2/20 0.34
GBA1 P04062 2/20 0.32

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
SCHEMBL4665788 0.98 SCN2A (0.36) NOS1NOS2NOS3SCN2AGBA1
SCHEMBL11138004 0.98 SCN2A (0.36) NOS1NOS2NOS3SCN2AGBA1
SCHEMBL20954129 0.98 SCN2A (0.36) NOS1NOS2NOS3SCN2AGBA1
SCHEMBL20954138 0.98 SCN2A (0.36) NOS1NOS2NOS3SCN2AGBA1
SCHEMBL7778391 0.91 LMNA (0.39) SCN2AGBA1
SCHEMBL10903471 0.89 NOS1 (0.40) NOS1NOS2NOS3
SCHEMBL9955184 0.89 PSMD14 (0.34) SCN2AGBA1
SCHEMBL8034064 0.89 PSMD14 (0.34) SCN2AGBA1
SCHEMBL2007679 0.89 PSMD14 (0.34) SCN2AGBA1
SCHEMBL5986996 0.89 PSMD14 (0.34) SCN2AGBA1

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
EP-3087216-B1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF DOW GLOBAL TECHNOLOGIES LLC (US) 2018-10-10 EP disclosed
US-20160319442-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF DOW INTERNATIONAL TECHNOLOGY CORPORATION 2016-11-03 US disclosed
US-6380237-B1 AS PESTICIDE BAYER AKTIENGESELLSCHAFT (DE) 2002-04-30 US disclosed
EP-1095023-A1 DIPHENYLIMIDAZOLINES BAYER AG (DE) 2001-05-02 EP disclosed
WO-2000003995-A1 DIPHENYLIMIDAZOLINES BAYER AKTIENGESELLSCHAFT (DE) 2000-01-27 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-20160319442-A1 BIS-IMIDAZOLINE COMPOUNDS AS CORROSION INHIBITORS AND PREPARATION THEREOF SOD1, FHIT, TFPI NOS1 268/4885NOS2 223/4885NOS3 291/4885

“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.