SCHEMBL10272441

SCHEMBL10272441

CN(C)Cc1ccc(C(=O)NCC(C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 1/20 0.61
▸ MCHR1 Q99705 1/20 0.53
▸ CNR2 P34972 1/20 0.52
▸ ADORA2A P29274 1/20 0.48
▸ EPHX2 P34913 7/20 0.48
▸ NR1H4 Q96RI1 5/20 0.48
▸ MLLT3 P42568 1/20 0.46
▸ MLLT1 Q03111 1/20 0.46
▸ NAMPT P43490 1/20 0.45
▸ TMEM97 Q5BJF2 1/20 0.45
▸ SIGMAR1 Q99720 1/20 0.45
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44
▸ HDAC3 O15379 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43

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
SCHEMBL17865785 0.84 ADORA2A (0.59) CNR2ADORA2AEPHX2NR1H4NAMPT
SCHEMBL12388322 0.81 PLK1 (0.59) ADORA2AEPHX2NR1H4NAMPTHDAC8
SCHEMBL19197526 0.81 LSS (0.61) LSSMCHR1MLLT3MLLT1TMEM97
SCHEMBL507205 0.80 ADORA2A (0.50) ADORA2AEPHX2NR1H4NAMPTHDAC8
SCHEMBL10223360 0.79 LSS (0.56) LSSMCHR1EPHX2NR1H4MLLT3
SCHEMBL14045108 0.79 MCHR1 (0.62) LSSMCHR1MLLT3MLLT1TMEM97
SCHEMBL13113117 0.79 LSS (0.58) LSSMCHR1EPHX2NR1H4MLLT3
SCHEMBL6024562 0.78 NPC1 (0.58) ADORA2ANAMPTHDAC6HTTKMT2A
SCHEMBL13483866 0.78 RAB9A (0.60) EPHX2NR1H4HDAC8HDAC6HDAC3
SCHEMBL19197462 0.78 PLK1 (0.63) LSSMCHR1EPHX2NR1H4HDAC8

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-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 — — US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 — — 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-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR LSS 3757/4885MCHR1 158/4885CNR2 233/4885

“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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