SCHEMBL10838759

SCHEMBL10838759

CCCNC(=O)c1ccccc1N(CC)c1ccncc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ADRA1D P25100 1/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ ADRA1B P35368 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HPGD P15428 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ NAAA Q02083 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL10839348 0.80 CDC7 (0.39) HTTTSHRALDH1A1HPGDKDM4E
SCHEMBL2484487 0.76 TSHR (0.57) HTTTSHRADRA1DADRA1AADRA1B
SCHEMBL10838068 0.72 L3MBTL1 (0.54) HTTTSHRADRA1DADRA1AADRA1B
SCHEMBL24484638 0.69 TSHR (0.45) HTTTSHRADRA1DADRA1AADRA1B
SCHEMBL9549393 0.69 NAAA (0.63) HTTTSHRALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL6359135 0.69 NAAA (0.75) TSHRALDH1A1SMN1; SMN2L3MBTL1KDM4E
SCHEMBL6684555 0.69 P2RX7 (0.45) HTTTSHRALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL2577570 0.68 L3MBTL1 (0.64) HTTTSHRADRA1DADRA1AADRA1B
SCHEMBL28773230 0.68 ALDH1A1 (0.46) TSHRALDH1A1SMN1; SMN2HPGDKDM4E
SCHEMBL10838466 0.68 HTT (0.43) HTTTSHRADRA1DADRA1AADRA1B

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-4610991-A Antihypertensive pyridylaminobenzamide compounds STERLING DRUG INC. (US) 1986-09-09 — — US disclosed
EP-0098951-A2 Aminobenzamide derivatives and preparation thereof STERLING DRUG INC. (US) 1984-01-25 — — EP disclosed
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