SCHEMBL1997761

SCHEMBL1997761

CC(C)(C)c1cccc(C(C)(C)C)c1-c1cc(-c2ccccc2)ccc1OPO

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 9/20 0.36
RARA P10276 2/20 0.35
RARB P10826 2/20 0.35
RARG P13631 2/20 0.35
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
SLC6A9 P48067 3/20 0.34
PTPN5 P54829 1/20 0.34
ACLY P53396 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
SYK P43405 1/20 0.33
NR1I2 O75469 1/20 0.32
CYP2C8 P10632 1/20 0.32
PTPN1 P18031 1/20 0.32

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
SCHEMBL500051 0.82 CA2 (0.33) IDO1PTPN5
SCHEMBL1902946 0.81 RXRA (0.38) RARARARBRARGRXRARXRB
SCHEMBL499968 0.80 CA2 (0.33) IDO1PTPN5
SCHEMBL27998067 0.80 IDO1 (0.38) IDO1RARARARBRARGRXRA
SCHEMBL1996342 0.78 RXRA (0.35) RXRARXRBSLC6A9PTPN5MEN1
SCHEMBL2001065 0.78 PTPN5 (0.35) IDO1RXRARXRBPTPN5
SCHEMBL544838 0.72 PTPN5 (0.32) PTPN5
SCHEMBL1898406 0.72 IDO1 (0.33) IDO1PTPN5ACLY
SCHEMBL29512344 0.72 RXRA (0.35) RARARARBRARGRXRARXRB
SCHEMBL27926529 0.70 CA2 (0.41) RXRARXRBPTPN5MEN1KMT2A

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-8969436-B2 Method of producing a molded article TEIJIN CHEMICALS, LTD. (JP) 2015-03-03 US disclosed
US-20110147992-A1 METHOD OF PRODUCING A MOLDED ARTICLE TEIJIN CHEMICALS, LTD. (JP) 2011-06-23 US disclosed