SCHEMBL7184590

SCHEMBL7184590

CCC(C)Oc1ccc(PC(=O)c2c(C(F)(F)F)cccc2C(F)(F)F)c(C)c1.[LiH]

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
CTSS P25774 2/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
PPARD Q03181 1/20 0.33
GRM2 Q14416 1/20 0.32
ACACB O00763 2/20 0.32
HPGD P15428 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
PLA2G1B P04054 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
SCN9A Q15858 2/20 0.32
PDK2 Q15119 1/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX2 P34913 2/20 0.31
MAPT P10636 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL7177812 0.89 MRGPRX4 (0.33) CTSSMAOAMAOBPPARDGRM2
SCHEMBL7182439 0.89 PDK2 (0.38) MAOAMAOBTDP1PLA2G1BATG4B
Lithium SCHEMBL7177817 0.87 MRGPRX4 (0.33) CTSSMAOAMAOBPPARDGRM2
SCHEMBL7175702 0.86 SMN1; SMN2 (0.38) SMN1; SMN2ACACBTDP1MAPTPPARG
SCHEMBL7189202 0.85 KMT2A (0.42) SMN1; SMN2MAOAMAOBPPARDHPGD
Lithium SCHEMBL7188242 0.85 PPARD (0.34) SMN1; SMN2MAOAMAOBPPARDHPGD
SCHEMBL7182639 0.85 PDK2 (0.40) MAOAMAOBPPARDHPGDPDK2
Lithium SCHEMBL7181101 0.84 TDP1 (0.33) SMN1; SMN2MAOAMAOBHPGDTDP1
SCHEMBL7180691 0.84 SMN1; SMN2 (0.36) SMN1; SMN2ACACBTDP1KMT2AMAPT
SCHEMBL7177823 0.84 ACACB (0.37) CTSSMAOAMAOBGRM2ACACB

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 SMN1; SMN2 2939/4885CTSS 4260/4885MAOA 4231/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 SMN1; SMN2 3105/4885CTSS 4218/4885MAOA 4267/4885

“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.