SCHEMBL1607135

SCHEMBL1607135

CCCc1cc(C(=O)O)n(Cc2ccc(F)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 6/20 0.58
HDAC3 O15379 5/20 0.58
HDAC4 P56524 5/20 0.58
HDAC1 Q13547 5/20 0.58
HDAC7 Q8WUI4 5/20 0.58
HDAC2 Q92769 5/20 0.58
HDAC10 Q969S8 5/20 0.58
HDAC11 Q96DB2 5/20 0.58
HDAC8 Q9BY41 5/20 0.58
HDAC9 Q9UKV0 5/20 0.58
HDAC5 Q9UQL6 5/20 0.58
NCOR2 Q9Y618 5/20 0.58
GRN P28799 3/20 0.53
SORT1 Q99523 3/20 0.53
ALDH1A1 P00352 1/20 0.48
P2RY14 Q15391 4/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GAA P10253 1/20 0.42

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
SCHEMBL1606646 0.84 GRN (0.51) GRNSORT1
SCHEMBL22000813 0.82 HDAC3 (0.55) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7192267 0.80 P2RY14 (0.56) GRNSORT1ALDH1A1P2RY14MAPT
SCHEMBL7934400 0.79 P2RY14 (0.55) GRNSORT1ALDH1A1P2RY14MAPT
SCHEMBL4490129 0.78 GRN (0.78) GRNSORT1ALDH1A1MAPTMAPK1
SCHEMBL1017 0.78 GRN (0.43) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL1607222 0.77 MEN1 (0.62) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7373270 0.75 GRN (0.56) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL28251767 0.73 ALDH1A1 (0.41) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL24283666 0.73 GRN (0.76) GRNSORT1ALDH1A1MAPTMAPK1

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-8148413-B2 N-heteroaryl indole carboxamides and analogues thereof, for use as glucokinase activators in the treatment of diabetes TRANSTECH PHARMA, INC. (US) 2012-04-03 US disclosed
US-20110082144-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES TRANSTECH PHARMA, INC. (US) 2011-04-07 US disclosed
US-7812043-B2 N-heteroaryl indole carboxamides and analogues thereof, for use as glucokinase activators in the treatment of diabetes TRANSTECH PHARMA, INC. (US) 2010-10-12 US disclosed
US-20070027140-A1 N-heteroaryl indole carboxamides and analogues thereof, for use as glcokinase activators in the treatment of diabetes NOVO NORDISK A/S (DK) 2007-02-01 US disclosed
EP-1689392-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2006-08-16 EP disclosed
WO-2005049019-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES NOVO NORDISK A/S (DK) 2005-06-02 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-20070027140-A1 N-heteroaryl indole carboxamides and analogues thereof, for use as glcokinase activators in the treatment of diabetes GALK1, GCKR, GCK HDAC6 1383/4885HDAC3 1356/4885HDAC4 1902/4885
US-20110082144-A1 N-HETEROARYL INDOLE CARBOXAMIDES AND ANALOGUES THEREOF, FOR USE AS GLUCOKINASE ACTIVATORS IN THE TREATMENT OF DIABETES GCKR, GCK, GALK1 HDAC6 1118/4885HDAC3 481/4885HDAC4 937/4885

“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.