SCHEMBL1317197

SCHEMBL1317197

Cc1c(C(=O)O)sc(NC(=O)OC(C)(C)C)c1C#N

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.48
▸ APOBEC3G Q9HC16 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ BRAF P15056 3/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.42
▸ HPGD P15428 5/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.40

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
SCHEMBL1315750 0.89 ALDH1A1 (0.55) RXFP1APOBEC3GALDH1A1MEN1KMT2A
SCHEMBL13285490 0.79 CA1 (0.39) ALDH1A1KMT2AHPGD
SCHEMBL9098968 0.78 LCK (0.36) SMN1; SMN2HSD17B10
SCHEMBL2645060 0.77 RXFP1 (0.53) RXFP1APOBEC3GALDH1A1MEN1KMT2A
SCHEMBL2644226 0.75 APOBEC3G (0.72) RXFP1APOBEC3GALDH1A1MEN1KMT2A
SCHEMBL9291582 0.75 ALDH1A1 (0.39) ALDH1A1MEN1KMT2ALMNAMAPK1
SCHEMBL2644453 0.73 APOBEC3G (0.58) RXFP1APOBEC3GALDH1A1MEN1KMT2A
SCHEMBL9097459 0.73 GRIA4 (0.49) KMT2A
SCHEMBL2644079 0.73 APOBEC3G (0.61) RXFP1APOBEC3GALDH1A1MEN1KMT2A
SCHEMBL2644158 0.72 ALDH1A1 (0.61) RXFP1APOBEC3GALDH1A1MEN1KMT2A

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-8809538-B2 Piperidine-containing compounds and use thereof ARRAY BIOPHARMA INC. (US) 2014-08-19 — — US disclosed
US-8809538-B2 Piperidine-containing compounds and use thereof ARRAY BIOPHARMA INC. (US) 2014-08-19 — — US disclosed
US-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-11-10 — — US disclosed
US-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2011-11-10 — — US disclosed
EP-2375899-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF Array Biopharma, Inc. (US) 2011-10-19 — — EP disclosed
WO-2010080864-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF ARRAY BIOPHARMA INC. (US) 2010-07-15 — — 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-20110275608-A1 PIPERIDINE-CONTAINING COMPOUNDS AND USE THEREOF NOS1, NOS2, ASS1 RXFP1 1257/4885APOBEC3G 2943/4885ALDH1A1 28/4885

“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.

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