SCHEMBL4970458

SCHEMBL4970458

Cc1ccc(C2c3cc(C)ccc3OC2(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.37
SLC6A2 P23975 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
GAA P10253 1/20 0.36
SIRT2 Q8IXJ6 2/20 0.34
ESR2 Q92731 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
MAOB P27338 3/20 0.33
KCNA5 P22460 1/20 0.32
THRB P10828 1/20 0.31
LMNA P02545 1/20 0.31
ABCC9 O60706 1/20 0.31

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
SCHEMBL4973173 0.91 LMNA (0.40) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL4969761 0.90 GAA (0.48) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL4972701 0.88 MAOB (0.40) GAAALDH1A1MAOBKCNA5LMNA
SCHEMBL3603597 0.88 MAPT (0.33) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL4972270 0.83 KCNE1 (0.38) HTR2BESR2ALDH1A1MAOBLMNA
SCHEMBL2473650 0.77 HTR7 (0.35) HTR2BSIGMAR1CNR1CNR2ALDH1A1
SCHEMBL15253596 0.77 HTR2C (0.40) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL5868353 0.72 IDO1 (0.40) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL5868357 0.72 IDO1 (0.40) HTR1ASLC6A2HTR2CHTR2BSIGMAR1
SCHEMBL6274078 0.72 IDO1 (0.40) HTR1ASLC6A2HTR2CHTR2BSIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408036-B1 PROCESS FOR PRODUCING BENZOFURAN DERIVATIVE TAKEDA PHARMACEUTICAL (JP) 2008-08-27 EP disclosed
US-7323577-B2 Process for producing benzofuran derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-29 US disclosed
US-20060142598-A1 Process for producing benzofuran derivative TAWADA HIROYUKI 2006-06-29 US disclosed
US-7034166-B2 Process for producing benzofuran derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-25 US disclosed
US-20040210066-A1 Process for producing benzofuran derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-10-21 US disclosed
EP-1408036-A1 PROCESS FOR PRODUCING BENZOFURAN DERIVATIVE Takeda Chemical Industries, Ltd. (JP) 2004-04-14 EP 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-20040210066-A1 Process for producing benzofuran derivative IWS1, HAT1, BRD1 HTR1A 1944/4885SLC6A2 4391/4885HTR2C 1416/4885
US-20060142598-A1 Process for producing benzofuran derivative AHR, CBR3, HAT1 HTR1A 2179/4885SLC6A2 4260/4885HTR2C 1589/4885

“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.