SCHEMBL3205245

SCHEMBL3205245

O=C(O)CCNC(=O)c1ccc(Cn2ccc3cc(NS(=O)(=O)c4ccc(OC(F)(F)F)cc4)ccc32)cc1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GCGR P47871 14/20 0.52
TRPV1 Q8NER1 2/20 0.49
GIPR P48546 4/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C8 P10632 1/20 0.48
CYP2C9 P11712 1/20 0.48
KCNH2 Q12809 1/20 0.48
SERPINE1 P05121 1/20 0.48
NAMPT P43490 1/20 0.45
ADCY6 O43306 1/20 0.45
ADCY3 O60266 1/20 0.45
ADCY9 O60503 1/20 0.45
ADCY5 O95622 1/20 0.45
ADCY8 P40145 1/20 0.45
ADCY7 P51828 1/20 0.45
ADCY2 Q08462 1/20 0.45
ADCY1 Q08828 1/20 0.45
ADCY4 Q8NFM4 1/20 0.45
GLP1R P43220 1/20 0.45

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
SCHEMBL3198691 0.87 EPHX2 (0.51) GCGRSERPINE1ADCY6ADCY3ADCY9
SCHEMBL3198713 0.86 SERPINE1 (0.52) CYP2C9SERPINE1
SCHEMBL27739285 0.86 GCGR (0.47) GCGRTRPV1GIPRCYP3A4CYP2C8
SCHEMBL3185435 0.82 SERPINE1 (0.52) GCGRTRPV1SERPINE1NAMPT
SCHEMBL3185508 0.75 EPHX2 (0.62) SERPINE1
SCHEMBL3195396 0.75 NR1I2 (0.54) SERPINE1
SCHEMBL28582450 0.75 RORC (0.73) GCGR
SCHEMBL28568243 0.74 HDAC6 (0.57) GCGRTRPV1
SCHEMBL3193674 0.73 SERPINE1 (0.55) SERPINE1
SCHEMBL28771623 0.73 EPHX2 (0.47) GCGRADCY6ADCY3ADCY9ADCY5

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-20100137363-A1 Substituted Indoles And Methods Of Their Use WYETH LLC (US) 2010-06-03 US claimed
US-7683091-B2 Substituted indoles and methods of their use WYETH (US) 2010-03-23 US claimed
US-20070043101-A1 Substituted indoles and methods of their use WYETH (US) 2007-02-22 US claimed
US-20100137363-A1 Substituted Indoles And Methods Of Their Use WYETH LLC (US) 2010-06-03 US disclosed
US-7683091-B2 Substituted indoles and methods of their use WYETH (US) 2010-03-23 US disclosed
EP-1919866-A2 SUBSTITUTED INDOLES AND USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-05-14 EP disclosed
US-20070043101-A1 Substituted indoles and methods of their use WYETH (US) 2007-02-22 US disclosed
WO-2007022321-A2 SUBSTITUTED INDOLES AND USE THEREOF WYETH (US) 2007-02-22 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-20070043101-A1 Substituted indoles and methods of their use INMT, AANAT, IDO2 GCGR 3296/4885TRPV1 4014/4885GIPR 2294/4885
US-20100137363-A1 Substituted Indoles And Methods Of Their Use INMT, AANAT, IDO2 GCGR 3296/4885TRPV1 4014/4885GIPR 2294/4885

“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.