SCHEMBL11489692

SCHEMBL11489692

CC(CCNCCN(C)C)c1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ UTS2R Q9UKP6 13/20 0.46
▸ TSHR P16473 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL11489460 0.92 UTS2R (0.45) UTS2RALDH1A1L3MBTL1
SCHEMBL11494123 0.87 UTS2R (0.47) UTS2RTSHRNPSR1
SCHEMBL11496317 0.87 MEN1 (0.44) UTS2RNPSR1
SCHEMBL11495855 0.86 UTS2R (0.52) UTS2RTSHRL3MBTL1
SCHEMBL11489538 0.85 FFAR1 (0.39) UTS2R
SCHEMBL11493561 0.83 FFAR1 (0.39) UTS2R
SCHEMBL11496101 0.82 KMT2A (0.42) TSHRL3MBTL1
SCHEMBL11496048 0.82 FFAR1 (0.39) UTS2R
SCHEMBL11489266 0.80 SLC6A4 (0.52) UTS2R
SCHEMBL11604596 0.80 UTS2R (0.46) UTS2R

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
US-4239759-A Morpholino containing compounds, compositions and use thereof MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-12-16 — — US disclosed
US-4110447-A Anti-inflammatory (halo-4-biphenylyl)-alkanolamines MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1978-08-29 — — US disclosed
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