SCHEMBL7180980

SCHEMBL7180980

CCCCCOc1ccc(PC(=O)c2c(Cl)cccc2OC)c(OCCCCC)c1.[LiH]

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 2/20 0.43
THRB P10828 2/20 0.43
MAPT P10636 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
KMT2A Q03164 1/20 0.41
PLA2G4B P0C869 3/20 0.39
PPARA Q07869 1/20 0.39
SMPD1 P17405 2/20 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
SCHEMBL7182731 0.99 THRA (0.44) THRATHRBMAPTTDP1L3MBTL1
Lithium SCHEMBL7180985 0.98 THRA (0.43) THRATHRBMAPTTDP1L3MBTL1
SCHEMBL7181770 0.98 MEN1 (0.42) THRATHRBMAPTTDP1L3MBTL1
Lithium SCHEMBL7181773 0.96 MEN1 (0.42) THRATHRBMAPTTDP1L3MBTL1
SCHEMBL7186779 0.95 PLA2G4B (0.43) THRATHRBPLA2G4BSMPD1
SCHEMBL7189884 0.94 ELANE (0.42) MAPTTDP1L3MBTL1MEN1GAA
SCHEMBL7182160 0.94 PLA2G4B (0.45) THRATHRBPLA2G4BSMPD1
SCHEMBL7175103 0.94 THRB (0.46) THRATHRBMAPTL3MBTL1PLA2G4B
SCHEMBL7181178 0.93 THRA (0.47) THRATHRBPLA2G4BPPARASMPD1
SCHEMBL7182885 0.92 FAAH (0.41) THRATHRBTDP1L3MBTL1MEN1

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 2119/4885MAPT 4870/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 THRA 2159/4885THRB 2521/4885MAPT 4859/4885

“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.