SCHEMBL6417565

SCHEMBL6417565

CC(C)N(C(C)C)P(O)OC(CC#N)CCCCCCNC(=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX1 P07099 1/20 0.40
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CA14 Q9ULX7 2/20 0.36
CA3 P07451 2/20 0.36
CA5A P35218 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL7168721 0.81 ACHE (0.33) ALDH1A1
SCHEMBL18307167 0.75 EPHX1 (0.50) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL963229 0.74 TSHR (0.31)
SCHEMBL714350 0.71 MEN1 (0.43) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL6045455 0.69 ALDH1A1 (0.41) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL10586606 0.69 MEN1 (0.53) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL19769248 0.68 MEN1 (0.70) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL13864345 0.68 KMT2A (0.51) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL16574759 0.68 ALDH1A1 (0.49) MEN1KMT2AEPHX1ALDH1A1POLB
SCHEMBL27052880 0.67 MEN1 (0.38) MEN1KMT2AEPHX1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8697607-B2 Generation and application of standardized universal libraries CHEN TAO (CA) 2014-04-15 US disclosed
US-20050214782-A1 Generation and application of standardized universal libraries CHEN TAO 2005-09-29 US disclosed
US-6921816-B2 Chimerical peptide-nucleic acid fragment, process for producing the same and its for appropriately introducing nucleic acids into cell organelles and cells Seibel, Peter (DE) 2005-07-26 US disclosed
US-20030003463-A1 Methods and devices for measuring differential gene expression CURAGEN CORPORATION 2003-01-02 US disclosed
US-6355423-B1 IDENTIFYING AND QUANTIFYING NUCLEIC ACIDS IN A SAMPLE WITH ACCURATE AND EFFICIENT USE OF ARRAYED OLIGONUCLEOTIDES, CALLED A UNIVERSAL DETECTION ARRAY; NUCLEIC ACID SEQUENCES IN SAMPLES ARE IDENTIFIED IN A DATABASE BASED ON POSITIONING CURAGEN CORPORATION 2002-03-12 US disclosed
US-20010008771-A1 CHIMERICAL PEPTIDE-NUCLEIC ACID FRAGMENT, PROCESS FOR PRODUCING THE SAME AND ITS FOR APPROPRIATELY INTRODUCING NUCLEIC ACIDS INTO CELL ORGANELLES AND CELLS SEIBEL, PETER (DE) 2001-07-19 US disclosed
WO-1999028505-A1 METHODS AND DEVICES FOR MEASURING DIFFERENTIAL GENE EXPRESSION CURAGEN CORPORATION (US) 1999-06-10 WO disclosed