Biricodar

Biricodar

SCHEMBL7546702

COc1cc(C(=O)C(=O)N2CCCC[C@@H]2C(=O)OC(CCCc2cccnc2)CCCc2cccnc2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCB1ABCC1

The experimentally established mechanism targets of Biricodar. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABCC1 known ✓ P33527 1/20 1.00
FKBP1A P62942 20/20 1.00
FKBP4 Q02790 3/20 1.00
FKBP5 Q13451 3/20 1.00

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
Biricodar SCHEMBL29405867 1.00 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
Biricodar SCHEMBL154547 1.00 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
Biricodar SCHEMBL13038499 1.00 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL29393244 0.98 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL7129468 0.98 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL14401254 0.98 FKBP1A (1.00) FKBP1AFKBP4FKBP5ABCC1
Biricodar SCHEMBL355913 0.92 FKBP1A (0.85) FKBP1AFKBP4FKBP5ABCC1
Biricodar SCHEMBL29860052 0.92 FKBP1A (0.85) FKBP1AFKBP4FKBP5ABCC1
Biricodar SCHEMBL1648827 0.92 FKBP1A (0.84) FKBP1AFKBP4FKBP5ABCC1
SCHEMBL3673581 0.88 FKBP1A (0.78) FKBP1AFKBP4FKBP5ABCC1

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-5620971-A Biologically active acylated amino acid derivatives VERTEX PHARMACEUTICALS INCORPORATED (US) 1997-04-15 US claimed
EP-0662958-B1 1-(2-OXO-ACETYL)-PIPERIDINE-2-CARBOXYLIC ACID DERIVATIVES AS MULTI-DRUG-RESISTENT CANCER CELL SENSITIZERS VERTEX PHARMA (US) 2002-12-11 EP disclosed