SCHEMBL10752471

SCHEMBL10752471

COC(Br)C(=O)c1ccc(S(=O)(=O)N(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ MAPT P10636 3/20 0.49
▸ ALDH1A1 P00352 8/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ GAA P10253 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ OPRD1 P41143 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ATM Q13315 1/20 0.42
▸ TRPV4 Q9HBA0 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
SCHEMBL10747959 0.82 ENPP2 (0.42) —
SCHEMBL10753390 0.81 CA2 (0.53) —
SCHEMBL10754745 0.78 SMN1; SMN2 (0.46) SMN1; SMN2MAPTALDH1A1LMNAHTT
SCHEMBL17290281 0.77 ALDH1A1 (0.50) SMN1; SMN2MAPTALDH1A1LMNAHTT
SCHEMBL10754928 0.77 ALDH1A1 (0.52) SMN1; SMN2MAPTALDH1A1HTTOPRD1
SCHEMBL65856 0.75 SMN1; SMN2 (0.64) SMN1; SMN2MAPTALDH1A1LMNAHTT
SCHEMBL5249012 0.74 SMN1; SMN2 (0.57) SMN1; SMN2MAPTALDH1A1LMNAHTT
SCHEMBL10756141 0.73 ALDH1A1 (0.44) MAPTALDH1A1HTT
SCHEMBL27520267 0.73 CA1 (0.53) MAPTALDH1A1GAATSHRL3MBTL1
SCHEMBL10752669 0.73 PARP10 (0.52) SMN1; SMN2MAPTALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4716169-A INOTROPIC AGENTS DR. KARL THOMAE GMBH (DE) 1987-12-29 — — US disclosed
EP-0185345-A1 Imidazo derivatives, their preparation and medicines containing them Dr. Karl Thomae GmbH (DE) 1986-06-25 — — EP disclosed
EP-0185346-A2 Imidazo derivatives, their preparation and medicaments containing these compounds Dr. Karl Thomae GmbH (DE) 1986-06-25 — — EP disclosed
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