SCHEMBL9484341

SCHEMBL9484341

CC(N)Oc1ccc(CCNS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
POLB P06746 1/20 0.61
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
TBXA2R P21731 1/20 0.60
TBXAS1 P24557 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.58
PRMT1 Q99873 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HTT P42858 1/20 0.54
CA12 O43570 1/20 0.54
ADRB2 P07550 1/20 0.54
ADRB1 P08588 1/20 0.54
CA9 Q16790 1/20 0.54
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
MAPT P10636 1/20 0.51

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
SCHEMBL9493082 0.87 MEN1 (0.64) ALDH1A1POLBTBXA2RSMN1; SMN2PRMT1
SCHEMBL9020868 0.82 ALDH1A1 (0.65) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL12676129 0.80 TBXA2R (0.71) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL6565074 0.79 ALDH1A1 (0.64) ALDH1A1POLBCA1CA2TBXA2R
Hydrochloric Acid SCHEMBL6565204 0.78 ALDH1A1 (0.62) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL412302 0.78 ALDH1A1 (0.79) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL9130476 0.77 TBXA2R (0.68) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL8971065 0.77 TBXA2R (0.68) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL6804085 0.77 PRMT1 (0.88) ALDH1A1POLBCA1CA2TBXA2R
SCHEMBL10460354 0.77 ALDH1A1 (0.70) ALDH1A1POLBCA1CA2TBXA2R

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
EP-0564499-A1 NOVEL AMINES, PROCESS FOR PRODUCING THEM AND MEDICAMENTS CONTAINING SAID COMPOUNDS. BOEHRINGER MANNHEIM GMBH (DE) 1993-10-13 EP disclosed