SCHEMBL8026520

SCHEMBL8026520

CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2OCP(=O)(c2ccccc2)c2ccccc2)c(OCP(=O)(c2ccccc2)c2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
GAA P10253 1/20 0.47
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
RECQL P46063 1/20 0.41
RXRA P19793 8/20 0.39
RXRB P28702 5/20 0.39
RXRG P48443 5/20 0.39
RARA P10276 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL14617487 0.73 ELANE (0.46) MEN1KMT2AALDH1A1LMNARECQL
SCHEMBL8028404 0.72 RXRA (0.38) ALDH1A1RXRARXRBRXRGRARA
SCHEMBL16301295 0.70 RAB9A (0.34) MEN1KMT2AALDH1A1CYP1A2CYP2C19
SCHEMBL24359494 0.69 EGFR (0.39) RXRARXRBRXRGRARACYP1A2
Lithium SCHEMBL29601477 0.69 EGFR (0.38) RXRARXRBRXRGRARACYP1A2
SCHEMBL23143159 0.68 RXRA (0.50) RXRARXRBRXRGRARACYP3A4
SCHEMBL26081392 0.68 RXRA (0.37) ALDH1A1RXRARXRBRXRGRARA
SCHEMBL12020468 0.67 BTN3A1 (0.36) ALDH1A1CYP1A2CYP2C19CYP3A4CYP2C9
SCHEMBL8028400 0.67 CYP1A2 (0.35) ALDH1A1RXRARXRBRXRGRARA
SCHEMBL22320162 0.67 RXRA (0.36) ALDH1A1RXRARXRBRXRGRARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0653431-B1 Bis-(phosphinoalkoxy)-biaryl compounds and a process for preparing them CELANESE CHEM EUROPE GMBH (DE) 2000-03-01 EP disclosed
US-5498797-A Bis(phosphinozlkoxy)biaryl compounds and a process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 US disclosed
EP-0653431-A1 Bis-(phosphinoalkoxy)-biaryl compounds and a process for preparing them HOECHST AKTIENGESELLSCHAFT (DE) 1995-05-17 EP disclosed