SCHEMBL7600206

SCHEMBL7600206

CCNC(=O)OC1(CCCCBr)c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.39
MTTP P55157 1/20 0.36
LMNA P02545 1/20 0.34

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
SCHEMBL7595652 0.90 PDK2 (0.41) PDK2MTTP
SCHEMBL7599983 0.86 PDK2 (0.37) PDK2
SCHEMBL7599929 0.85 TP53 (0.39)
SCHEMBL7600360 0.84 LMNA (0.38) PDK2LMNA
SCHEMBL7597632 0.84 ALDH1A1 (0.44) PDK2LMNA
SCHEMBL7600948 0.84 MTTP (0.43) PDK2MTTP
SCHEMBL7595140 0.83 CA12 (0.42)
SCHEMBL7612764 0.83 MAPT (0.38) PDK2
SCHEMBL7596692 0.82 MTTP (0.36) PDK2MTTP
SCHEMBL7597301 0.82 KMT2A (0.39) LMNA

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
EP-1255736-A2 SUBSTITUTED PIPERAZINE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN (MTP) Boehringer Ingelheim Pharma KG (DE) 2002-11-13 EP disclosed
WO-2001047898-A2 SUBSTITUTED PIPERAZINE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN (MTP) BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-07-05 WO disclosed