SCHEMBL17148520

SCHEMBL17148520

CC(=O)c1cnc(C(C)C)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MAPK1 P28482 4/20 0.37
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ GAA P10253 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ TYK2 P29597 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ THRA P10827 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ GLP1R P43220 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
SCHEMBL12763742 0.86 HCAR2 (0.43) KMT2ASMN1; SMN2LMNAHTTMAPT
SCHEMBL17148533 0.84 HTT (0.41) KMT2ASMN1; SMN2LMNAHTTMAPT
SCHEMBL2750289 0.83 MAPK1 (0.41) KMT2AMAPK1MAOAMAOBALDH1A1
SCHEMBL2421365 0.77 KMT2A (0.51) KMT2ASMN1; SMN2MAPK1ALDH1A1MEN1
SCHEMBL2750787 0.76 KMT2A (0.43) KMT2ASMN1; SMN2HTTMAPTMAPK1
SCHEMBL9195960 0.76 CA5A (0.40) KMT2ASMN1; SMN2LMNAHTTMAPT
SCHEMBL13562372 0.75 PKM (0.38) KMT2AMAPTMAPK1ALDH1A1MEN1
SCHEMBL15044970 0.75 KMT2A (0.32) KMT2ASMN1; SMN2LMNAHTTMAPT
SCHEMBL9192048 0.74 CYP2D6 (0.45) KMT2AMAPK1ALDH1A1MEN1RXFP1
SCHEMBL2609312 0.72 LMNA (0.44) KMT2ASMN1; SMN2LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9657009-B2 Heteroaryl substituted pyridyl compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-23 — — US disclosed
US-20150284382-A1 HETEROARYL SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2015-10-08 — — US 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-20150284382-A1 HETEROARYL SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE MODULATORS IRAK4, IRAK3, IRAK2 KMT2A 332/4885SMN1; SMN2 2995/4885LMNA 3192/4885

“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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