SCHEMBL10223590

SCHEMBL10223590

CN(C)CCCN(C)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.64
▸ LMNA P02545 2/20 0.55
▸ SIGMAR1 Q99720 5/20 0.51
▸ TMEM97 Q5BJF2 3/20 0.51
▸ NR1I2 O75469 1/20 0.48
▸ ADRA2A P08913 1/20 0.48
▸ CYP2D6 P10635 1/20 0.48
▸ ACHE P22303 1/20 0.48
▸ SLC6A2 P23975 1/20 0.48
▸ HTR2A P28223 1/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.42
▸ ACKR3 P25106 1/20 0.42
▸ HIF1A Q16665 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ PYCR1 P32322 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ CARM1 Q86X55 1/20 0.38
▸ PRMT6 Q96LA8 1/20 0.38

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
SCHEMBL18714772 0.88 SIGMAR1 (0.50) KCNH2LMNASIGMAR1TMEM97NR1I2
SCHEMBL18714849 0.81 SIGMAR1 (0.58) KCNH2LMNASIGMAR1TMEM97NR1I2
SCHEMBL28049309 0.80 LMNA (0.49) KCNH2LMNASIGMAR1TMEM97NR1I2
SCHEMBL10272321 0.79 MEN1 (0.49) KCNH2LMNASIGMAR1TMEM97ACHE
SCHEMBL18516614 0.79 PYCR1 (0.52) SIGMAR1TMEM97ACHEHRH3PYCR1
SCHEMBL798094 0.78 HRH3 (0.58) KCNH2LMNASIGMAR1NR1I2ADRA2A
SCHEMBL3143091 0.78 MAPT (0.50) KCNH2SIGMAR1TMEM97HRH3PYCR1
SCHEMBL18714851 0.78 SIGMAR1 (0.54) KCNH2LMNASIGMAR1TMEM97ACHE
SCHEMBL18714779 0.77 SIGMAR1 (0.50) KCNH2LMNASIGMAR1TMEM97NR1I2
SCHEMBL12449593 0.77 SIGMAR1 (0.47) KCNH2LMNASIGMAR1TMEM97NR1I2

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-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 — — US disclosed
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
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 — — US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 — — US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 — — US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 — — US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 — — US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 — — 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 (3 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 KCNH2 4750/4885LMNA 4411/4885SIGMAR1 2096/4885
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR KCNH2 3780/4885LMNA 4840/4885SIGMAR1 650/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 KCNH2 3729/4885LMNA 2388/4885SIGMAR1 4683/4885

“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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