SCHEMBL719665

SCHEMBL719665

CCOC(=O)c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.52
PKM P14618 1/20 0.51
PTGS2 P35354 2/20 0.49
KIF11 P52732 1/20 0.49
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
L3MBTL1 Q9Y468 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
CHRNA7 P36544 2/20 0.45
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL10052768 0.84 NPC1 (0.57) NPC1PKMCA12CA9L3MBTL1
SCHEMBL722526 0.80 KIF11 (0.56) PTGS2KIF11LMNA
SCHEMBL2979630 0.79 TSHR (0.46) NPC1PKMCA12CA9L3MBTL1
SCHEMBL22924372 0.79 NPC1 (0.55) NPC1PKMCA12CA9L3MBTL1
SCHEMBL18016057 0.78 KMT2A (0.59) PTGS2CA12CA9MEN1KMT2A
SCHEMBL28526673 0.77 TSHR (0.49) CA12CA9L3MBTL1MEN1KMT2A
SCHEMBL6827036 0.76 CA12 (0.64) PKMCA12CA9L3MBTL1MEN1
SCHEMBL25954514 0.75 NPC1 (0.49) NPC1PKMCA12CA9L3MBTL1
SCHEMBL7222675 0.75 TSHR (0.53) NPC1PKMCA12CA9L3MBTL1
SCHEMBL367075 0.75 TSHR (0.57) NPC1PKMCA12CA9L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 US disclosed
US-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS CHEMIZON, A DIVISION OF OPTOMAGIC CO., LTD. (KR) 2012-03-01 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-20120053180-A1 CYCLOHEXANE ANALOGUES AS GPR119 AGONISTS GPR119, GLP1R, GIPR NPC1 684/4885PKM 2553/4885PTGS2 1777/4885

“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.