SCHEMBL13323732

SCHEMBL13323732

C=C(Oc1ccc(F)cc1F)C(=O)Nc1ccon1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 5/20 0.45
▸ RAB9A P51151 4/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ TSHR P16473 2/20 0.45
▸ GAA P10253 1/20 0.43
▸ POLB P06746 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.38
▸ KMT2A Q03164 4/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ GPR6 P46095 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
SCHEMBL2658498 0.75 GCK (0.50) SMN1; SMN2RAB9ANPC1TSHRGAA
SCHEMBL15774335 0.72 SMN1; SMN2 (0.69) SMN1; SMN2RAB9ANPC1TSHRGAA
SCHEMBL10658758 0.68 CES2 (0.48) RAB9ATSHRPOLBTDP1MAPT
SCHEMBL3596299 0.66 RAB9A (0.51) SMN1; SMN2RAB9ANPC1TSHRGAA
SCHEMBL2914318 0.65 CES2 (0.48) RAB9ATSHRPOLBTDP1MAPT
SCHEMBL29462972 0.65 CES2 (0.48) RAB9ATSHRPOLBTDP1MAPT
SCHEMBL18697359 0.65 CES2 (0.48) RAB9ATSHRPOLBTDP1MAPT
SCHEMBL15774580 0.65 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1TSHRGAA
SCHEMBL18309868 0.65 MAPT (0.48) RAB9ATSHRPOLBTDP1MAPT
SCHEMBL13113182 0.64 RAB9A (0.54) SMN1; SMN2RAB9ANPC1TSHRGAA

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-20100144772-A1 2,2,2-TRI-SUBSTITUTED ACETAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION ADVINUS THERAPEUTICS PRIVATE LIMITED (IN) 2010-06-10 — — 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-20100144772-A1 2,2,2-TRI-SUBSTITUTED ACETAMIDE DERIVATIVES AS GLUCOKINASE ACTIVATORS, THEIR PROCESS AND PHARMACEUTICAL APPLICATION GCK, GCKR, GALK1 SMN1; SMN2 3208/4885RAB9A 3630/4885NPC1 3867/4885

“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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