SCHEMBL6182056

SCHEMBL6182056

FC(F)(F)c1cc(-c2ccc(CCl)cc2)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.51
▸ NOTUM Q6P988 10/20 0.49
▸ RXRA P19793 1/20 0.45
▸ RXRB P28702 1/20 0.45
▸ RXRG P48443 1/20 0.45
▸ KIF11 P52732 1/20 0.44
▸ PYCR1 P32322 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ GPR84 Q9NQS5 1/20 0.43
▸ USP1 O94782 1/20 0.41
▸ WDR48 Q8TAF3 1/20 0.41
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 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
SCHEMBL15090399 0.87 KIF11 (0.49) IDO1NOTUMRXRARXRBRXRG
SCHEMBL932921 0.85 IDO1 (0.62) IDO1NOTUMPYCR1GPR84
SCHEMBL2698021 0.84 NOTUM (0.61) IDO1NOTUMCYP1A2PDE3BPDE3A
SCHEMBL12603808 0.84 IDO1 (0.50) IDO1NOTUMRXRARXRBRXRG
SCHEMBL5513337 0.84 KIF11 (0.63) IDO1NOTUMRXRARXRBRXRG
SCHEMBL19523185 0.81 CTSS (0.52) IDO1NOTUMRXRARXRBRXRG
SCHEMBL17297764 0.80 KDM4E (0.48) IDO1NOTUMRXRARXRBRXRG
SCHEMBL1041571 0.79 NOTUM (0.53) IDO1NOTUMKIF11CYP1A2USP1
SCHEMBL875588 0.78 IDO1 (0.51) IDO1PYCR1GPR84
SCHEMBL12508243 0.78 AR (0.57) IDO1NOTUMCYP1A2PDE3BPDE3A

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39916-E1 Compounds that modulate PPAR activity and methods for their preparation WARNER LAMBERT COMPANY (US) 2007-11-06 — — US disclosed
US-RE39916-E1 Compounds that modulate PPAR activity and methods for their preparation WARNER LAMBERT COMPANY (US) 2007-11-06 — — US disclosed
US-6964983-B2 Compounds that modulate PPAR activity and methods for their preparation WARNER-LAMBERT COMPANY, LLC (US) 2005-11-15 — — US disclosed
US-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION AUERBACH BRUCE J (US) 2005-07-14 — — US disclosed
US-20050113440-A1 Compounds that modulate PPAR activity and methods for their preparation AUERBACH BRUCE J (US) 2005-05-26 — — US disclosed
EP-1494989-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2005-01-12 — — EP disclosed
US-20030225158-A1 Compounds that modulate PPAR activity and methods for their preparation WARNER-LAMBERT COMPANY 2003-12-04 — — US disclosed
WO-2003084916-A2 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION WARNER-LAMBERT COMPANY LLC (US) 2003-10-16 — — WO 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 (3 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-20030225158-A1 Compounds that modulate PPAR activity and methods for their preparation GPR119, PPARA, PPARG IDO1 3753/4885NOTUM 1370/4885RXRA 68/4885
US-20050113440-A1 Compounds that modulate PPAR activity and methods for their preparation GPR119, PPARA, PPARG IDO1 3753/4885NOTUM 1370/4885RXRA 68/4885
US-20050153996-A1 COMPOUNDS THAT MODULATE PPAR ACTIVITY AND METHODS FOR THEIR PREPARATION GPR119, PPARA, PPARG IDO1 3753/4885NOTUM 1370/4885RXRA 68/4885

“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.

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