SCHEMBL7184423

SCHEMBL7184423

CCCCOc1cc(OCCCC)c(PC(=O)c2c(C)cc(C(C)(C)C)cc2C)c(OCCCC)c1.[LiH]

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.39
THRA P10827 1/20 0.39
NR1I2 O75469 3/20 0.36
PPARG P37231 4/20 0.36
PPARA Q07869 3/20 0.36
PPARD Q03181 2/20 0.36
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
ESR1 P03372 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
PLA2G2A P14555 1/20 0.35
ELANE P08246 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
RXRA P19793 1/20 0.34

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
SCHEMBL7182727 0.96 THRB (0.43) THRBTHRAITGB1ITGA4ESR1
SCHEMBL7186955 0.95 THRB (0.45) THRBTHRAITGB1ITGA4ESR1
SCHEMBL7188781 0.94 MAPT (0.35) THRBTHRANR1I2PPARGPPARA
SCHEMBL7177697 0.89 ITGB1 (0.44) THRBTHRAPPARGPPARAITGB1
SCHEMBL7188930 0.88 FFAR1 (0.34) THRBTHRAPPARGPPARAPPARD
SCHEMBL7732347 0.88 F2R (0.33) NR1I2PPARGPPARAPPARDPOLB
SCHEMBL7180764 0.86 EPHX2 (0.36) PPARGESR1RAB9AELANERXRA
SCHEMBL7183681 0.86 PPARG (0.39) THRBTHRANR1I2PPARGPPARA
SCHEMBL7189924 0.86 ESR1 (0.36) NR1I2PPARGPPARAPPARDESR1
SCHEMBL7174863 0.85 PPARG (0.43) THRBTHRAPPARGPPARAPPARD

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 1901/4885NR1I2 501/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 THRB 2521/4885THRA 2159/4885NR1I2 821/4885

“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.