Carbromal

Carbromal

SCHEMBL8656167

CCC(Br)(CC)C(=O)NC(N)=O.[Ru].c1ccc(-c2ccccn2)nc1

nearest known ligand 0.39

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
P4HTM Q9NXG6 3/20 0.39
LMNA P02545 2/20 0.39
CCR1 P32246 2/20 0.39
CCR5 P51681 2/20 0.39
CCR8 P51685 2/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
METAP1 P53582 1/20 0.39
BLM P54132 1/20 0.39
HIF1A Q16665 1/20 0.39
DOHH Q9BU89 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
KDM6B O15054 1/20 0.37
KDM4A O75164 1/20 0.37
KDM5C P41229 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
KDM3A Q9Y4C1 1/20 0.37

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
Carbromal SCHEMBL518268 0.99 KDM4E (0.40) KDM4EP4HTMLMNACCR1CCR5
Carbromal SCHEMBL517670 0.96 KDM4E (0.38) KDM4EP4HTMLMNACCR1CCR5
Carbromal SCHEMBL7904148 0.91 TRPV1 (0.43) KDM4ECYP1A2ALDH1A1TRPV1
Carbromal SCHEMBL5972678 0.81 ALDH1A1 (0.45) LMNACYP1A2POLBALDH1A1TSHR
Carbromal SCHEMBL2139358 0.81 NR3C1 (0.40) KDM4ECYP1A2POLBALDH1A1
Carbromal SCHEMBL3134121 0.81 NR3C1 (0.31)
Carbromal SCHEMBL6662108 0.80 CRBN (0.37) RAB9A
Benzophenone SCHEMBL5055881 0.80 ALDH1A1 (0.44) LMNAALDH1A1NPC1RAB9ASMN1; SMN2
Anthracene SCHEMBL1711430 0.79 NR3C1 (0.39) KDM4EPOLBALDH1A1RAB9ATDP1
Carbromal SCHEMBL6907293 0.79 SMN1; SMN2 (0.40) LMNAPOLBALDH1A1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811526-A LUMINESCENT IRIDIUM COMPLEXES, E.G. IR(BIPY)2(4'-(1,10-PHENANTHROLINE))-PHENOXYACETIC ACID)(3+),FOR IMMUNOASSAY; STABILITY; LONG LIFE; NONTOXIC ALUSUISSE HOLDINGS A.G. (CH) 1998-09-22 US disclosed
US-5585279-A IMMUNOASSAYS LONZA GROUP, AG (CH) 1996-12-17 US disclosed
EP-0255534-B1 BINDING ASSAY AND ASSAY REAGENT CELLTECH LIMITED (GB) 1992-04-08 EP disclosed
EP-0255534-A1 BINDING ASSAY AND ASSAY REAGENT. DAVIDSON ROBERT STEPHEN 1988-02-10 EP disclosed
WO-1987004523-A1 BINDING ASSAY AND ASSAY REAGENT DAVIDSON ROBERT STEPHEN 1987-07-30 WO disclosed