SCHEMBL10272590

SCHEMBL10272590

CN(CC[N+](C)(C)C)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ SIGMAR1 Q99720 2/20 0.47
▸ NR1I2 O75469 1/20 0.47
▸ ADRA2A P08913 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ HTR2A P28223 1/20 0.47
▸ SLC6A4 P31645 1/20 0.47
▸ TMEM97 Q5BJF2 1/20 0.44
▸ PYCR1 P32322 2/20 0.38
▸ CARM1 Q86X55 1/20 0.37
▸ PRMT6 Q96LA8 1/20 0.37
▸ PRMT8 Q9NR22 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ NR1H4 Q96RI1 2/20 0.36
▸ ACKR3 P25106 1/20 0.36
▸ ESRRG P62508 1/20 0.36

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
SCHEMBL14045036 0.80 KDM4E (0.47) SIGMAR1CYP2D6ACHEPYCR1CARM1
SCHEMBL28049309 0.79 LMNA (0.49) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL10223590 0.77 KCNH2 (0.64) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL18714772 0.76 SIGMAR1 (0.50) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL12449593 0.76 SIGMAR1 (0.47) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL18714779 0.76 SIGMAR1 (0.50) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL12891088 0.76 KCNH2 (0.53) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL12201774 0.75 SIGMAR1 (0.56) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL25530530 0.74 LMNA (0.51) LMNAKCNH2SIGMAR1NR1I2ADRA2A
SCHEMBL15942946 0.73 SIGMAR1 (0.58) LMNAKCNH2SIGMAR1NR1I2ADRA2A

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 3 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
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 — — 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 (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-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR LMNA 4840/4885KCNH2 3780/4885SIGMAR1 650/4885
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 LMNA 2388/4885KCNH2 3729/4885SIGMAR1 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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