SCHEMBL7182872

SCHEMBL7182872

CCCCOc1ccc(PC(=O)c2c(C(F)(F)F)cccc2C(F)(F)F)c(OCCCC)c1.[LiH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
FAAH O00519 1/20 0.41
PPARG P37231 5/20 0.39
CYP2D6 P10635 3/20 0.39
PTGES O14684 3/20 0.39
ALOX5 P09917 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
PDK2 Q15119 2/20 0.39
CACNA1B Q00975 2/20 0.39
MEN1 O00255 1/20 0.39
ADRB2 P07550 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARA Q07869 4/20 0.38
PPARD Q03181 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL7181374 0.98 THRA (0.44) THRATHRBFAAHPPARGCYP2D6
Lithium SCHEMBL7182881 0.98 THRB (0.41) THRATHRBFAAHPPARGCYP2D6
SCHEMBL7179765 0.97 THRA (0.46) THRATHRBFAAHCYP2D6PDK2
SCHEMBL7177770 0.96 KMT2A (0.40) THRATHRBFAAHPPARGCYP2D6
Lithium SCHEMBL7177779 0.93 KMT2A (0.40) THRATHRBFAAHPPARGCYP2D6
SCHEMBL7188859 0.90 LMNA (0.41) THRAPPARGCYP2D6CYP1A2CYP3A4
SCHEMBL7182798 0.90 MRGPRX4 (0.39) PPARGCYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL7186968 0.89 CYP2D6 (0.41) THRATHRBFAAHPPARGCYP2D6
SCHEMBL7184698 0.89 KDM4E (0.42) PDK2KMT2AMRGPRX4
SCHEMBL7186999 0.88 PDK2 (0.42) PPARGCYP2D6CYP1A2CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6579663-B2 Chemical intermediates such as lithium 2,6-dimethylbenzoyl phenylphosphine for preparation of acylphosphines, acylphosphine oxides or acylphosphine sulfides CIBA SPECIALTY CHEMICALS CORPORATION 2003-06-17 US disclosed
US-20020107413-A1 Organometallic monoacylarylphosphines WOLF JEAN-PIERRE (CH) 2002-08-08 US disclosed
US-6399805-B2 SUCH AS LITHIUM 2,6-DIMETHYLBENZOYLPHENYLPHOSPHINE, USE AS PHOTOINITIATORS IN PHOTOCURABLE COMPOSITIONS SUCH AS FOR PHOTOGRAPHIC PRODUCTION OF RELIEF IMAGES CIBA SPECIALTY CHEMICALS CORPORATION 2002-06-04 US disclosed
US-20010031898-A1 Organometallic monoacylarylphosphines CIBA SPECIALTY CHEMICALS CORP. 2001-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020107413-A1 Organometallic monoacylarylphosphines CBR1, NAF1, DHCR24 THRA 1901/4885THRB 2119/4885FAAH 3151/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 THRA 2159/4885THRB 2521/4885FAAH 2825/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.