SCHEMBL24951048

SCHEMBL24951048

CCCNCc1cc(CCC(=O)O)cc(C(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.46
▸ FFAR4 Q5NUL3 3/20 0.46
▸ RHOC P08134 1/20 0.45
▸ RHOA P61586 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ S1PR1 P21453 2/20 0.42
▸ S1PR3 Q99500 2/20 0.42
▸ S1PR2 O95136 1/20 0.42
▸ PPARA Q07869 2/20 0.41
▸ THRA P10827 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ PPARD Q03181 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ MTOR P42345 1/20 0.40
▸ TACR1 P25103 1/20 0.40
▸ TRPA1 O75762 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL18255658 0.83 FFAR1 (0.50) FFAR1FFAR4PPARATHRATHRB
SCHEMBL5939432 0.81 RHOC (0.59) FFAR1FFAR4RHOCRHOAKDM4E
SCHEMBL18252816 0.80 FFAR1 (0.47) FFAR1FFAR4PPARATHRATHRB
SCHEMBL1015795 0.79 LMNA (0.54) FFAR1FFAR4THRATHRBLMNA
SCHEMBL21346465 0.77 FFAR1 (0.45) FFAR1FFAR4PPARATHRATHRB
SCHEMBL13536889 0.76 S1PR1 (0.66) FFAR1FFAR4S1PR1S1PR3S1PR2
SCHEMBL30151169 0.75 FFAR4 (0.48) FFAR1FFAR4PPARATHRATHRB
SCHEMBL16033358 0.75 TACR1 (0.50) FFAR1FFAR4RHOCRHOALMNA
SCHEMBL17310946 0.73 RXRA (0.51) FFAR1FFAR4THRATHRBLMNA
SCHEMBL30151135 0.72 THRA (0.47) FFAR1FFAR4PPARATHRATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230023075-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CHEMOCENTRYX, INC. 2023-01-26 — — 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 (1 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-20230023075-A1 COMBINATION THERAPY USING A CHEMOKINE RECEPTOR 2 (CCR2) ANTAGONIST AND A PD-1/PD-L1 INHIBITOR CCR2, PDCD1LG2, CD274 FFAR1 563/4885FFAR4 747/4885RHOC 3277/4885

“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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