SCHEMBL17737480

SCHEMBL17737480

CC(C)Oc1ccc(S(=O)(=O)Nc2cc(Cl)cc3cnccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 2/20 0.46
▸ CCR9 P51686 2/20 0.43
▸ LMNA P02545 2/20 0.42
▸ PIK3CA P42336 1/20 0.41
▸ SLC40A1 Q9NP59 1/20 0.41
▸ IDO1 P14902 1/20 0.41
▸ CCR2 P41597 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ DRD2 P14416 2/20 0.39
▸ DRD3 P35462 2/20 0.39
▸ HTR6 P50406 2/20 0.39
▸ CYP2D6 P10635 2/20 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
SCHEMBL17737478 0.85 ALDH1A1 (0.52) CCR9PIK3CASLC40A1IDO1CCR2
SCHEMBL17737455 0.83 IDO1 (0.55) FFAR4LMNASLC40A1IDO1MEN1
SCHEMBL22536974 0.78 CYP3A4 (0.35) LMNAALDH1A1TP53HTTCHUK
SCHEMBL17737469 0.76 ALOX12 (0.56) FFAR4LMNASLC40A1IDO1MEN1
SCHEMBL12161518 0.76 FFAR4 (0.51) FFAR4CCR9LMNACCR2MEN1
SCHEMBL19852984 0.75 ALDH1A1 (0.52) CCR9PIK3CASLC40A1CCR2MEN1
SCHEMBL10222601 0.75 FFAR4 (0.50) FFAR4CCR9LMNACCR2MEN1
SCHEMBL10223642 0.75 FFAR4 (0.43) FFAR4CCR9LMNACCR2MEN1
SCHEMBL10223736 0.73 CCR2 (0.58) FFAR4CCR9LMNACCR2MEN1
SCHEMBL28063 0.73 CCR2 (0.50) FFAR4CCR9LMNACCR2ALDH1A1

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
EP-3215155-B1 INHIBITORS OF TRYPTOPHAN-2,3-DIOXYGENASE OR INDOLEAMINE-2,3-DIOXYGENASE IOMET PHARMA LTD (GB) 2020-10-14 — — EP disclosed
US-10287252-B2 Inhibitors of tryptophan-2,3-dioxygenase or indoleamine-2,3-dioxygenase IOMET PHARMA LTD. (GB) 2019-05-14 — — US disclosed
US-20180037553-A1 INHIBITORS OF TRYPTOPHAN-2,3-DIOXYGENASE OR INDOLEAMINE-2,3-DIOXYGENASE IOMET PHARMA LTD. (GB) 2018-02-08 — — US disclosed
WO-2016071283-A1 INHIBITORS OF TRYPTOPHAN-2,3-DIOXYGENASE OR INDOLEAMINE-2,3-DIOXYGENASE IOMET PHARMA LTD (GB) 2016-05-12 — — 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 (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-10287252-B2 Inhibitors of tryptophan-2,3-dioxygenase or indoleamine-2,3-dioxygenase TDO2, IDO2, IDO1 FFAR4 2470/4885CCR9 1656/4885LMNA 3562/4885
US-20180037553-A1 INHIBITORS OF TRYPTOPHAN-2,3-DIOXYGENASE OR INDOLEAMINE-2,3-DIOXYGENASE TDO2, IDO2, IDO1 FFAR4 2470/4885CCR9 1656/4885LMNA 3562/4885

“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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