SCHEMBL16698196

SCHEMBL16698196

CON(C(=O)c1oc2ccccc2c1C)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.54
RAB9A P51151 3/20 0.54
ADRA2A P08913 1/20 0.50
ADRA2C P18825 1/20 0.50
DRD3 P35462 1/20 0.50
HTR2B P41595 1/20 0.50
HTT P42858 3/20 0.48
PKM P14618 1/20 0.48
GPR55 Q9Y2T6 1/20 0.48
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
KCNH2 Q12809 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 3/20 0.46
TSHR P16473 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL720540 0.81 HTT (0.54) KMT2ARAB9AHTTPKMGPR55
SCHEMBL442779 0.75 MCL1 (0.60) KMT2ARAB9AHTTLMNAMAPK1
SCHEMBL443475 0.74 KDM4E (0.73) KMT2ARAB9AHTTGPR55LMNA
SCHEMBL879305 0.74 KCNH2 (0.59) KMT2ARAB9AHTTGPR55LMNA
Hydrochloric Acid SCHEMBL9789912 0.74 MCL1 (0.58) KMT2ARAB9AHTTLMNAMAPK1
SCHEMBL15619119 0.72 KCNH2 (0.56) KMT2ARAB9AHTTLMNAMAPK1
SCHEMBL114250 0.72 KMT2A (0.60) KMT2ARAB9AHTTLMNAMAPK1
SCHEMBL28810376 0.71 KCNH2 (0.63) KMT2ARAB9AHTTPKMLMNA
SCHEMBL30608270 0.71 NPC1 (0.66) KMT2ARAB9AHTTLMNAMAPK1
SCHEMBL25472764 0.71 KCNH2 (0.58) KMT2ARAB9AHTTLMNAMAPK1

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-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2017-06-29 US disclosed
US-9532983-B2 Benzofuran compounds, compositions, kits and/or methods thereof SAVANNAH STATE UNIVERSITY (US) 2017-01-03 US disclosed
US-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SAVANNAH STATE UNIVERSITY 2015-05-14 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-20150133498-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 KMT2A 1248/4885RAB9A 4758/4885ADRA2A 78/4885
US-20170182023-A1 BENZOFURAN COMPOUNDS, COMPOSITIONS, KITS AND/OR METHODS THEREOF SIGMAR1, OPRM1, OPRL1 KMT2A 1248/4885RAB9A 4758/4885ADRA2A 78/4885

“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.