SCHEMBL7174863

SCHEMBL7174863

CCCCOc1cc(OCCCC)c(PC(=O)c2c(C)cccc2C)c(OCCCC)c1.[LiH]

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.43
PPARA Q07869 7/20 0.43
ALOX5 P09917 6/20 0.43
PTGES O14684 5/20 0.43
PPARD Q03181 2/20 0.41
TP53 P04637 2/20 0.40
TSHR P16473 1/20 0.40
USP2 O75604 1/20 0.38
MAPK1 P28482 1/20 0.38
THRB P10828 2/20 0.38
PLA2G4B P0C869 1/20 0.38
THRA P10827 1/20 0.38
PTPN11 Q06124 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL7175321 0.96 THRB (0.42) PPARGPPARAALOX5PTGESTHRB
SCHEMBL7184676 0.95 THRB (0.44) TP53TSHRTHRBPLA2G4BTHRA
SCHEMBL7185561 0.94 KMT2A (0.42) PPARGPPARAALOX5PTGESPPARD
SCHEMBL7189062 0.92 PPARG (0.40) PPARGPPARAALOX5PTGESPPARD
SCHEMBL7177697 0.89 ITGB1 (0.44) PPARGPPARAALOX5PTGESTHRB
SCHEMBL7180541 0.89 THRB (0.40) PPARGPPARAALOX5PTGESTHRB
SCHEMBL7178292 0.88 FFAR1 (0.41) PPARGPPARAPPARDTHRAMAPT
SCHEMBL7189393 0.88 THRB (0.42) THRBPLA2G4BTHRA
SCHEMBL7181815 0.88 L3MBTL1 (0.40) PPARGPPARAPPARD
SCHEMBL7187854 0.88 FAAH (0.41) PPARGPPARAPPARDUSP2MAPK1

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 PPARG 2956/4885PPARA 3039/4885ALOX5 1863/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 PPARG 2776/4885PPARA 2624/4885ALOX5 1672/4885

“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.