SCHEMBL2638367

SCHEMBL2638367

CCC(C#N)C(=O)c1ccc(C(=O)O)s1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DAO P14920 6/20 0.42
PKM P14618 1/20 0.39
LIG1 P18858 1/20 0.39
HPGD P15428 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL1587492 0.86 HPGD (0.46) HPGDALDH1A1TDP1RAB9ANPC1
SCHEMBL14625174 0.86 F2 (0.41) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL1588149 0.83 ALDH1A1 (0.42) ALDH1A1TDP1MAPTPOLBKMT2A
SCHEMBL14625177 0.83 KDM4E (0.41) HPGDALDH1A1TDP1RAB9ANPC1
SCHEMBL12529804 0.83 HPGD (0.44) HPGDALDH1A1TDP1RAB9ANPC1
SCHEMBL11977472 0.80 YEATS4 (0.42) DAOHPGDRAB9ANPC1KMT2A
SCHEMBL1588044 0.80 NPSR1 (0.40) HPGDALDH1A1MAPTPOLB
SCHEMBL31468333 0.73 PGR (0.47) ALDH1A1TDP1RAB9ANPC1MAPT
Alcohol SCHEMBL28943550 0.72 DAO (0.60) DAOPKMLIG1HPGDALDH1A1
SCHEMBL10161072 0.71 DAO (0.54) DAOPKMLIG1HPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968542-B2 Thiophene compounds and thrombopoietin receptor activators NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-06-28 US disclosed
US-20090118500-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD (JP) 2009-05-07 US disclosed
EP-1904472-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS Nissan Chemical Industries, Ltd. (JP) 2008-04-02 EP disclosed
WO-2007010954-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-01-25 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-20090118500-A1 THIOPHENE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATORS TEK, MPL, THPO DAO 2712/4885PKM 1966/4885LIG1 4208/4885

“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.