SCHEMBL7175118

SCHEMBL7175118

CCCCCOc1ccc(PC(=O)c2c(C(F)(F)F)cccc2C(F)(F)F)cc1.[LiH]

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.43
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
FAAH O00519 1/20 0.43
PLA2G4B P0C869 4/20 0.42
LTA4H P09960 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RARB P10826 3/20 0.40

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
SCHEMBL7186263 0.99 NR5A1 (0.46) NR5A1THRATHRBTP53TSHR
SCHEMBL7179835 0.98 FAAH (0.44) NR5A1THRATHRBFAAHLTA4H
SCHEMBL7181323 0.93 LMNA (0.41) FAAHLTA4HFFAR4CYP1A2CYP3A4
SCHEMBL7188429 0.88 KMT2A (0.49) TP53TSHR
SCHEMBL7181443 0.87 KMT2A (0.40) THRAFAAHFFAR4CYP1A2CYP3A4
SCHEMBL7188513 0.87 FFAR4 (0.39) FFAR4CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL7189874 0.85 MAPK1 (0.45) THRBTP53TSHRFFAR4CYP1A2
SCHEMBL7189708 0.84 ALDH1A1 (0.40) TSHRFAAHCYP3A4
SCHEMBL7181374 0.83 THRA (0.44) THRATHRBFAAHPLA2G4BCYP1A2
SCHEMBL7182314 0.83 THRA (0.44) THRATHRBFAAHPLA2G4BCYP1A2

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 NR5A1 49/4885THRA 1901/4885THRB 2119/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 NR5A1 133/4885THRA 2159/4885THRB 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.