SCHEMBL2664773

SCHEMBL2664773

CCOc1cc(OCC)cc(C(=O)Nc2ncc(C)s2)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
RAB9A P51151 9/20 0.59
NPC1 O15118 8/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.57
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
POLB P06746 1/20 0.53
TSHR P16473 1/20 0.53
PAX8 Q06710 1/20 0.51
PKM P14618 2/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
TP53 P04637 1/20 0.49

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
SCHEMBL13870307 0.95 ALDH1A1 (0.55) ALDH1A1RAB9ANPC1LMNASMN1; SMN2
SCHEMBL1262258 0.85 TSHR (0.52) ALDH1A1RAB9ANPC1LMNASMN1; SMN2
SCHEMBL2664776 0.81 GCK (0.60) ALDH1A1RAB9ANPC1LMNASMN1; SMN2
SCHEMBL12742436 0.80 SMN1; SMN2 (0.66) ALDH1A1RAB9ANPC1LMNASMN1; SMN2
SCHEMBL1263061 0.79 CDK2 (0.52) ALDH1A1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1262635 0.79 TSHR (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL2664785 0.79 GCK (0.60) ALDH1A1RAB9ANPC1LMNASMN1; SMN2
SCHEMBL1262488 0.78 CDK2 (0.57) ALDH1A1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL1262307 0.78 TSHR (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL2664772 0.77 GCK (0.69) RAB9ANPC1SMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-7951830-B2 Compounds effecting glucokinase ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE ASTRAZENECA AB (SE) 2009-09-10 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 US disclosed
US-7390908-B2 Such as 2-[3,5-Di(2-chlorobenzyloxy)benzoyl)amino]-thiazole; for treatment of diabetes ASTRAZENECA AB (SE) 2008-06-24 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-20090227592-A1 COMPOUNDS EFFECTING GLUCOKINASE GCKR, GCK, SLC5A2 ALDH1A1 1137/4885RAB9A 3175/4885NPC1 1139/4885

“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.