SCHEMBL1557531

SCHEMBL1557531

O=C(O)N1CCC(c2nccc(COc3ccc(-n4cnnn4)cc3F)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.48
USP2 O75604 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34

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
SCHEMBL1557229 0.89 GPR119 (0.60) GPR119
SCHEMBL1556639 0.86 GPR119 (0.48) GPR119USP2MAPK1ALDH1A1HPGD
SCHEMBL1557150 0.85 GPR119 (0.47) GPR119HPGDKMT2AMEN1RXRA
SCHEMBL11307513 0.85 GPR119 (0.43) GPR119RXRAGRIN1GRIN2B
Hydrochloric Acid SCHEMBL1557787 0.84 GPR119 (0.42) GPR119RXRAGRIN1GRIN2B
SCHEMBL1578058 0.84 GPR119 (0.47) GPR119USP2MAPK1ALDH1A1HPGD
SCHEMBL1556593 0.84 GPR119 (0.43) GPR119USP2MAPK1ALDH1A1HPGD
SCHEMBL1557532 0.83 GPR119 (0.49) GPR119RXRAGRIN1GRIN2B
SCHEMBL14142053 0.82 GPR119 (0.45) GPR119USP2MAPK1ALDH1A1HPGD
SCHEMBL1577809 0.80 GPR119 (0.43) GPR119USP2MAPK1ALDH1A1HPGD

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-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. 2012-07-19 US disclosed
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2011-12-01 US disclosed
EP-2303859-A2 ARYL GPR119 AGONISTS AND USES THEREOF Metabolex Inc. (US) 2011-04-06 EP disclosed
WO-2010008739-A2 ARYL GPR119 AGONISTS AND USES THEREOF METABOLEX, INC. (US) 2010-01-21 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-20120184572-A1 ARYL GPR119 AGONISTS AND USES THEREOF GPR119, GPR27, GPR65 GPR119 1/4885USP2 1701/4885MAPK1 2390/4885
US-20110294836-A1 ARYL GPR119 AGONISTS AND USES THEREOF GPR119, GPR27, GPR65 GPR119 1/4885USP2 1701/4885MAPK1 2390/4885

“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.