SCHEMBL1582014

SCHEMBL1582014

O=S(=O)(NCCc1ccccn1)c1ccc(C2(CO)CC2C2CCCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.50
▸ TSHR P16473 2/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ PKM P14618 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ ADORA2B P29275 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ HSD11B1 P28845 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ ATM Q13315 1/20 0.38

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
SCHEMBL1581947 0.84 RAB9A (0.52) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL12720782 0.83 RAB9A (0.51) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL9072594 0.82 RAB9A (0.50) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL1581520 0.77 GCK (0.65) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL12720684 0.77 GCK (0.65) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL13757051 0.77 GCK (0.65) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL1582066 0.76 GCK (0.67) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL13757074 0.76 GCK (0.67) RAB9ATSHRSMN1; SMN2LMNANPSR1
SCHEMBL1581711 0.76 SMN1; SMN2 (0.56) TSHRSMN1; SMN2LMNAPKMALDH1A1
SCHEMBL12720707 0.75 RAB9A (0.43) RAB9ATSHRSMN1; SMN2NPSR1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585739-B1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS LILLY CO ELI (US) 2011-04-20 — — EP disclosed
US-7576108-B2 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY (US) 2009-08-18 — — US disclosed
US-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators ELI LILLY AND COMPANY 2006-05-25 — — US disclosed
EP-1585739-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2005-10-19 — — EP disclosed
WO-2004063179-A1 SUBSTITUTED ARYLCYCLOPROPYLACETAMIDES AS GLUCOKINASE ACTIVATORS ELI LILLY AND COMPANY (US) 2004-07-29 — — 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 (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-20060111353-A1 Substituted arylcyclopropylacetamides as glucokinase activators GCK, GCKR, GALK1 RAB9A 3899/4885TSHR 2867/4885SMN1; SMN2 4420/4885

“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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