SCHEMBL8028404

SCHEMBL8028404

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 9/20 0.38
▸ RXRB P28702 5/20 0.38
▸ RXRG P48443 5/20 0.38
▸ RARA P10276 2/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PLA2G1B P04054 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SENP8 Q96LD8 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 1/20 0.31

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
SCHEMBL11525106 0.75 CYP1A2 (0.37) RXRARXRBRXRGRARACYP1A2
SCHEMBL24359494 0.74 EGFR (0.39) RXRARXRBRXRGRARACYP1A2
SCHEMBL3417517 0.73 CYP2C19 (0.42) RXRACYP1A2CYP3A4CYP2C9TSHR
Lithium SCHEMBL29601477 0.73 EGFR (0.38) RXRARXRBRXRGRARACYP1A2
SCHEMBL8026520 0.72 MEN1 (0.47) RXRARXRBRXRGRARACYP1A2
SCHEMBL26081392 0.72 RXRA (0.37) RXRARXRBRXRGRARACYP1A2
SCHEMBL22320162 0.71 RXRA (0.36) RXRARXRBRXRGRARACYP1A2
SCHEMBL23143159 0.70 RXRA (0.50) RXRARXRBRXRGRARACYP3A4
SCHEMBL11488213 0.70 CYP1A2 (0.36) CYP1A2CYP3A4CYP2C9TSHRCYP2C19
SCHEMBL4154409 0.70 TSHR (0.39) RXRACYP1A2CYP3A4CYP2C9TSHR

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
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