SCHEMBL9468320

SCHEMBL9468320

CCOC(=O)c1ccccc1Cc1ccc(CCN)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
ALDH1A1 P00352 2/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PDE3B Q13370 4/20 0.45
PDE3A Q14432 4/20 0.45
SCN1A P35498 2/20 0.45
SCN2A Q99250 2/20 0.45
SCN3A Q9NY46 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
RECQL P46063 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HTR6 P50406 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TAAR1 Q96RJ0 1/20 0.42

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
SCHEMBL6600799 0.85 TSHR (0.65) TSHRALDH1A1HSD17B10SCN1ASCN2A
SCHEMBL3642333 0.85 TSHR (0.65) TSHRALDH1A1HSD17B10MAPTMEN1
Bicarbonate SCHEMBL27544354 0.84 TSHR (0.62) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL12002522 0.83 PDE3B (0.61) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL7343458 0.83 TSHR (0.50) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL9468316 0.82 TSHR (0.56) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL11145446 0.82 TSHR (0.56) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL14906008 0.82 ALDH1A1 (0.56) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL11145093 0.82 TSHR (0.56) TSHRALDH1A1HSD17B10MAPTMEN1
SCHEMBL28280204 0.80 TSHR (0.61) TSHRALDH1A1HSD17B10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5232946-A Promoting weight gain and reduction of blood sugar and fat deposits in animals, feed efficiency DR. KARL THOMAE GMBH (DE) 1993-08-03 US disclosed