SCHEMBL1854450

SCHEMBL1854450

O=C(Cc1c[nH]c2ccccc12)NCC1CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.61
LMNA P02545 2/20 0.61
SMN1; SMN2 Q16637 3/20 0.58
GAA P10253 1/20 0.58
BCHE P06276 1/20 0.58
ACHE P22303 1/20 0.58
HTT P42858 2/20 0.57
MAPT P10636 3/20 0.56
PKM P14618 1/20 0.56
SIGMAR1 Q99720 1/20 0.55
HPGD P15428 3/20 0.54
RECQL P46063 1/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
STAT3 P40763 1/20 0.54
ALDH1A1 P00352 2/20 0.54
KDM4E B2RXH2 1/20 0.54
AANAT Q16613 1/20 0.53

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
SCHEMBL3594184 0.84 BCHE (0.57) NPY5RLMNASMN1; SMN2GAABCHE
SCHEMBL5340673 0.84 OPRL1 (0.63) NPY5RLMNASMN1; SMN2GAABCHE
Hydrochloric Acid SCHEMBL5336638 0.83 OPRL1 (0.62) NPY5RLMNASMN1; SMN2GAABCHE
SCHEMBL7976825 0.83 SMN1; SMN2 (0.71) LMNASMN1; SMN2GAAHTTMAPT
SCHEMBL7675954 0.81 HPGD (0.69) SMN1; SMN2GAABCHEACHEHTT
SCHEMBL7847712 0.80 HPGD (0.65) GAABCHEACHEHTTMAPT
SCHEMBL2402894 0.80 LMNA (0.67) LMNASMN1; SMN2GAAHTTMAPT
SCHEMBL1853622 0.80 LMNA (0.71) LMNASMN1; SMN2GAABCHEACHE
SCHEMBL468296 0.79 LMNA (0.65) LMNASMN1; SMN2GAAHTTMAPT
SCHEMBL10069200 0.79 AANAT (0.77) LMNAPKMKMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242116-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-08-14 US disclosed
EP-2035436-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2011-05-25 EP disclosed
US-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-06-03 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071888-A1 PYRROLOTHIAZOLES AS PI3-KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
EP-2035436-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-18 EP disclosed
WO-2008001076-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2008-01-03 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-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, PIK3CA NPY5R 3335/4885LMNA 4511/4885SMN1; SMN2 1521/4885

“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.