SCHEMBL7175757

SCHEMBL7175757

CCCCOc1ccc(PC(=O)c2c(C)cc(C)cc2C)c(C)c1.[LiH]

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 1/20 0.47
ITGA4 P13612 1/20 0.47
THRB P10828 4/20 0.41
THRA P10827 2/20 0.41
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
BRD4 O60885 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
PDE4A P27815 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HIF1A Q16665 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC6 Q9UBN7 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
SCHEMBL7183856 0.97 ITGB1 (0.50) ITGB1ITGA4THRBTHRA
SCHEMBL7184582 0.96 ITGB1 (0.49) ITGB1ITGA4THRBTHRA
SCHEMBL7189018 0.95 ITGB1 (0.42) ITGB1ITGA4THRBTHRABRD4
SCHEMBL7181077 0.90 ITGB1 (0.45) ITGB1ITGA4THRBTHRAPPARG
SCHEMBL7188475 0.90 THRB (0.41) THRBTHRAPPARGPPARABRD4
SCHEMBL7175989 0.90 ALDH1A1 (0.39) ITGB1ITGA4BRD4KDM4ECYP1A2
SCHEMBL7179994 0.89 THRB (0.39) ITGB1ITGA4THRBTHRAPPARG
SCHEMBL7181700 0.89 FFAR1 (0.39) ITGB1ITGA4THRABRD4KDM4E
SCHEMBL7177192 0.89 TDP1 (0.39) ITGB1ITGA4PPARGPPARABRD4
SCHEMBL7177461 0.88 ITGB1 (0.48) ITGB1ITGA4THRBTHRA

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 ITGB1 2786/4885ITGA4 3521/4885THRB 2119/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 ITGB1 3321/4885ITGA4 3643/4885THRB 2521/4885

“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.