SCHEMBL7188725

SCHEMBL7188725

CCCCCCOc1ccc(PC(=O)c2c(C)cc(C(C)(C)C)cc2C)c(C)c1.[LiH]

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.44
THRA P10827 2/20 0.44
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
PLA2G4B P0C869 2/20 0.40
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
S1PR5 Q9H228 1/20 0.39
PTPN11 Q06124 1/20 0.39

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
SCHEMBL7177466 0.99 THRB (0.42) THRBTHRATP53TSHRITGB1
SCHEMBL7179994 0.97 THRB (0.39) THRBTHRAITGB1ITGA4
SCHEMBL7175802 0.92 MAPT (0.39) THRBTHRATSHR
SCHEMBL7182184 0.91 THRA (0.40) THRBTHRATP53TSHRITGB1
SCHEMBL7179784 0.90 ITGB1 (0.39) THRBTHRATP53TSHRITGB1
SCHEMBL7184582 0.90 ITGB1 (0.49) THRBTHRATP53TSHRITGB1
SCHEMBL7183856 0.89 ITGB1 (0.50) THRBTHRATP53TSHRITGB1
SCHEMBL7183681 0.88 PPARG (0.39) THRBTHRAITGB1ITGA4
SCHEMBL7186708 0.87 THRA (0.46) THRBTHRATP53TSHRPLA2G4B
SCHEMBL7182657 0.87 EPHX2 (0.41) TSHR

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 THRB 2119/4885THRA 1901/4885TP53 3575/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 THRB 2521/4885THRA 2159/4885TP53 3524/4885

“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.