Carbromal

Carbromal

SCHEMBL7904148

CCC(Br)(CC)C(=O)NC(N)=O.c1ccc(-c2ccccn2)cc1

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.43
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
BRS3 P32247 2/20 0.38
CYP2A6 P11509 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
DHODH Q02127 1/20 0.37
NR3C1 P04150 1/20 0.37
KAT6A Q92794 1/20 0.37
ABL1 P00519 1/20 0.37
BCR P11274 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 0.92 KDM4E (0.40) TRPV1CYP1A2KDM4EALDH1A1
Carbromal SCHEMBL8656167 0.91 KDM4E (0.39) TRPV1CYP1A2KDM4EALDH1A1
Carbromal SCHEMBL517670 0.90 KDM4E (0.38) TRPV1CYP1A2KDM4EALDH1A1
Carbromal SCHEMBL6907293 0.85 SMN1; SMN2 (0.40) ALDH1A1NR3C1
Carbromal SCHEMBL11407016 0.83 SMN1; SMN2 (0.39) ALDH1A1NR3C1
Carbromal SCHEMBL9329686 0.83 SMN1; SMN2 (0.39) ALDH1A1NR3C1
Benzophenone SCHEMBL5055881 0.79 ALDH1A1 (0.44) ALDH1A1
Carbromal SCHEMBL6907632 0.79 RECQL (0.32) NR3C1
Carbromal SCHEMBL4373766 0.79 SOAT1 (0.41) ALDH1A1
Carbromal SCHEMBL4373776 0.79 SOAT1 (0.41) ALDH1A1

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-6242268-B1 USING WATER-SOLUBLE, FLUORESCENT, RARE EARTH METAL CHELATES AS TAGS ON SPECIFIC BINDING PARTNERS AND DETECTING FLUORESCENT EMISSION FROM SAMPLE AFTER FLUORESCENCE OF AMBIENT SUSBTANCES HAVE DECAYED EG&G WALLAC (FI) 2001-06-05 US disclosed
US-5830769-A QUANTITATIVE ANALYSIS; MEASURING FLUORESCENT EMISSION PERKINELMER LIFE SCIENCES, INC. 1998-11-03 US disclosed