SCHEMBL8533144

SCHEMBL8533144

CS(=O)(=O)c1cc(F)c2[nH]ccc2c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 3/20 0.43
▸ HTR6 P50406 1/20 0.41
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ NR3C2 P08235 1/20 0.38
▸ AR P10275 1/20 0.38
▸ CYP2D6 P10635 7/20 0.37
▸ SLC6A2 P23975 7/20 0.37
▸ SLC6A4 P31645 7/20 0.37
▸ SLC6A3 Q01959 7/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ TNF P01375 1/20 0.37
▸ RIPK1 Q13546 1/20 0.37
▸ GPR84 Q9NQS5 1/20 0.36
▸ BRD4 O60885 3/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ IKBKB O14920 1/20 0.35
▸ CHUK O15111 1/20 0.35

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
SCHEMBL10179821 0.81 NR3C1 (0.39) PTGS2NR3C1PGRNR3C2AR
SCHEMBL877284 0.79 AHR (0.43) PTGS2NR3C1PGRNR3C2AR
SCHEMBL10179498 0.79 HTR6 (0.44) PTGS2HTR6NR3C1PGRNR3C2
SCHEMBL10179278 0.74 ALDH1A1 (0.43) —
SCHEMBL2537652 0.73 AHR (0.50) NR3C1PGRARCYP2D6SLC6A2
SCHEMBL10179358 0.72 NR3C1 (0.41) PTGS2NR3C1PGRNR3C2AR
SCHEMBL1757934 0.72 MAPK1 (0.36) PTGS2
SCHEMBL987448 0.72 IKBKB (0.43) PTGS2IKBKBCHUK
SCHEMBL1394068 0.72 TNF (0.42) CYP2D6SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL794596 0.70 TNF (0.44) HTR6CYP2D6SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190192510-A1 GPR119 AGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2019-06-27 — — US disclosed
US-9000175-B2 Bicyclic GPR119 modulators LUPIN LIMITED (IN) 2015-04-07 — — US disclosed
EP-2643311-A1 BICYCLIC GPR119 MODULATORS Lupin Limited (IN) 2013-10-02 — — EP disclosed
US-20130245000-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2013-09-19 — — US disclosed
CN-102971304-A GPR119 agonists NIPPON CHEMIPHAR CO 2013-03-13 — — CN disclosed
EP-2532656-A1 GPR119 AGONIST Nippon Chemiphar Co., Ltd. (JP) 2012-12-12 — — EP disclosed
US-20120245344-A1 GPR119 AGONIST NIPPON CHEMIPHAR CO., LTD. (JP) 2012-09-27 — — US disclosed
EP-2474540-A1 GPR119 AGONIST Nippon Chemiphar Co., Ltd. (JP) 2012-07-11 — — EP disclosed
WO-2012069917-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2012-05-31 — — 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-20190192510-A1 GPR119 AGONIST GPR119, GPR4, GPR27 PTGS2 2743/4885HTR6 445/4885NR3C1 185/4885
US-20130245000-A1 BICYCLIC GPR119 MODULATORS GPR119, GPR180, GPBAR1 PTGS2 492/4885HTR6 302/4885NR3C1 139/4885
US-20120245344-A1 GPR119 AGONIST GPR119, GPR4, GPR55 PTGS2 2391/4885HTR6 446/4885NR3C1 253/4885

“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.

Send feedback