SCHEMBL13938121

SCHEMBL13938121

CC(C)/C=C\NCN

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL13373220 0.74
Hydrochloric Acid SCHEMBL22771601 0.72
Hydrochloric Acid SCHEMBL22771602 0.72
SCHEMBL3040468 0.71
SCHEMBL18951894 0.70
Hydrochloric Acid SCHEMBL22771756 0.69 ADH1B (0.40)
Hydrochloric Acid SCHEMBL22771757 0.69 ADH1B (0.40)
SCHEMBL18760813 0.67
SCHEMBL13005211 0.67
SCHEMBL25918248 0.67 TSHR (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2025671-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND THROMBOPOIETIN RECEPTOR ACTIVATOR Nissan Chemical Industries, Ltd. (JP) 2009-02-18 EP disclosed
WO-2007010954-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-01-25 WO disclosed