SCHEMBL18646469

SCHEMBL18646469

CC1=C(NCS)C(=O)N(C)C1=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.30
▸ NR1H3 Q13133 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
SCHEMBL22631927 0.73 NR1H2 (0.33) NR1H2NR1H3
SCHEMBL802733 0.68 ALDH1A1 (0.40) —
SCHEMBL23643488 0.61 NR1H2 (0.38) NR1H2NR1H3
SCHEMBL19629953 0.60 — —
SCHEMBL10119694 0.59 ALDH1A1 (0.31) —
SCHEMBL23169728 0.58 USP2 (0.39) NR1H2NR1H3
SCHEMBL6850987 0.58 GSK3A (0.44) NR1H2NR1H3
SCHEMBL11110220 0.58 ALDH1A1 (0.30) —
SCHEMBL19059392 0.58 BCL2A1 (0.32) —
SCHEMBL13878863 0.58 DUSP3 (0.35) —

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-3074451-B1 NOVEL POLYCYCLIC POLYMER COMPRISING THIOPHENE UNITS, A METHOD OF PRODUCING AND USES OF SUCH POLYMER MERCK PATENT GMBH (DE) 2017-12-27 — — EP disclosed
WO-2017041872-A1 LIGHT MODULATION ELEMENT MERCK PATENT GMBH (DE) 2017-03-16 — — WO disclosed
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