SCHEMBL7181996

SCHEMBL7181996

CCC(C)Oc1ccc(PC(=O)c2c(Cl)cccc2Cl)c(OC(C)CC)c1.[LiH]

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.35
PTGDR Q13258 1/20 0.35
ACACB O00763 5/20 0.34
MAPT P10636 1/20 0.33
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
GPBAR1 Q8TDU6 1/20 0.32
CYSLTR1 Q9Y271 1/20 0.32
MTNR1A P48039 4/20 0.32
MTNR1B P49286 4/20 0.32
HPGD P15428 1/20 0.32

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
Lithium SCHEMBL7182005 0.98 DHODH (0.35) DHODHPTGDRACACBMAPTCARM1
SCHEMBL7183488 0.94 HDAC1 (0.36) ACACBMAPTSMN1; SMN2HDAC1HDAC2
SCHEMBL7181314 0.94 DHODH (0.34) DHODHPTGDRACACBSMN1; SMN2HDAC1
Lithium SCHEMBL7183495 0.92 HDAC1 (0.36) ACACBMAPTSMN1; SMN2HDAC1HDAC2
Lithium SCHEMBL7181322 0.92 DHODH (0.34) DHODHPTGDRACACBSMN1; SMN2HDAC1
SCHEMBL7180691 0.88 SMN1; SMN2 (0.36) DHODHPTGDRACACBMAPTSMN1; SMN2
SCHEMBL7189324 0.88 ACACB (0.34) DHODHACACBMAPTSMN1; SMN2HDAC1
SCHEMBL7189006 0.87 MAPT (0.38) ACACBMAPTSMN1; SMN2HDAC1HDAC2
SCHEMBL7183717 0.87 DHODH (0.35) DHODHPTGDRACACBSMN1; SMN2GPBAR1
Lithium SCHEMBL7189334 0.86 ACACB (0.34) DHODHACACBMAPTSMN1; SMN2HDAC1

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 DHODH 2946/4885PTGDR 3402/4885ACACB 914/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 DHODH 2970/4885PTGDR 3682/4885ACACB 555/4885

“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.