SCHEMBL7180969

SCHEMBL7180969

Cc1cccc(Cl)c1P(=O)(C(=O)c1ccccc1)C(=O)c1c(C(F)(F)F)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.41
TYK2 P29597 1/20 0.39
PPARG P37231 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALDH1A1 P00352 2/20 0.36
ALOX12 P18054 2/20 0.36
MAPT P10636 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KCNK3 O14649 2/20 0.35
KCNK9 Q9NPC2 2/20 0.35
GAA P10253 1/20 0.35
PTGS2 P35354 1/20 0.35
HSD11B1 P28845 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
SCHEMBL7174859 0.90 RORC (0.39) RORCTYK2PPARGCYP3A4CYP2C9
SCHEMBL7182323 0.88 RORC (0.36) RORCTYK2PPARGCYP2C9ALDH1A1
SCHEMBL7182217 0.86 MAPT (0.39) RORCTYK2CYP2C9ALDH1A1MAPT
SCHEMBL7182450 0.86 FABP3 (0.39) RORCTYK2CYP2C9ALDH1A1MAPT
SCHEMBL7189010 0.85 SLC6A9 (0.41) RORCTYK2MAPTGAA
SCHEMBL7182455 0.85 ALDH1A1 (0.38) ALDH1A1ALOX12MAPTNPSR1KCNK3
SCHEMBL7190138 0.81 KMT2A (0.40) ALDH1A1MAPTKCNK3KCNK9GAA
SCHEMBL7180547 0.81 ALDH1A1 (0.38) ALDH1A1MAPTNPSR1KCNK3KCNK9
SCHEMBL7181260 0.81 ALDH1A1 (0.38) CYP2C9ALDH1A1ALOX12MAPTNPSR1
SCHEMBL7180976 0.81 TYK2 (0.43) RORCTYK2PPARGCYP3A4CYP2C9

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 RORC 1336/4885TYK2 1285/4885PPARG 2956/4885
US-20010031898-A1 Organometallic monoacylarylphosphines NAF1, DHCR24, CBR1 RORC 1254/4885TYK2 1333/4885PPARG 2776/4885

“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.