SCHEMBL5366703

SCHEMBL5366703

OC(COc1cccc(-c2noc3cc(F)ccc23)c1)CN1CCC(Cc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 6/20 0.58
GAA P10253 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
ATM Q13315 1/20 0.56
DRD2 P14416 3/20 0.52
HTR2A P28223 2/20 0.51
HTR1A P08908 1/20 0.49
USP2 O75604 1/20 0.49
ADRB2 P07550 1/20 0.48
ADRB1 P08588 1/20 0.48
ADRB3 P13945 1/20 0.48
POLB P06746 1/20 0.47
TSHR P16473 1/20 0.47
ABCB1 P08183 1/20 0.47

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
SCHEMBL5366699 1.00 DRD4 (0.58) DRD4GAAMEN1KMT2AATM
SCHEMBL5369926 0.92 DRD4 (0.60) DRD4GAAMEN1KMT2AATM
SCHEMBL5368949 0.92 DRD4 (0.60) DRD4GAAMEN1KMT2AATM
SCHEMBL5368944 0.92 DRD4 (0.60) DRD4GAAMEN1KMT2AATM
SCHEMBL5366298 0.89 HTR2A (0.54) DRD2HTR2AHTR1AUSP2
SCHEMBL5366310 0.89 HTR2A (0.54) DRD2HTR2AHTR1AUSP2
SCHEMBL5369015 0.88 USP2 (0.65) MEN1KMT2ADRD2HTR2AHTR1A
SCHEMBL5369007 0.88 USP2 (0.65) MEN1KMT2ADRD2HTR2AHTR1A
SCHEMBL5360652 0.83 DRD2 (0.48) DRD4DRD2HTR2AHTR1AUSP2
SCHEMBL5360657 0.83 DRD2 (0.48) DRD4DRD2HTR2AHTR1AUSP2

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-7253165-B2 Benzisoxazolyl-, pyridoisoxazolyl-and benzthienyl-phenoxy derivatives useful as D4 antagonists AVENTIS PHARMACEUTICALS INC. (US) 2007-08-07 US claimed
US-20050107377-A1 Benzisoxazolyl-,pyridoisoxazolyl-and benzthienyl-phenoxy derivatives useful as D4 antagonists AVENTIS PHARMACEUTIALS INC. (US) 2005-05-19 US claimed
EP-1216244-B1 Benzisoxazolyl-, pyridoisoxazolyl- and benzthienyl-phenoxy derivatives useful as D4 antagonists AVENTIS PHARMA INC (US) 2003-08-13 EP claimed

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-20050107377-A1 Benzisoxazolyl-,pyridoisoxazolyl-and benzthienyl-phenoxy derivatives useful as D4 antagonists DRD4, DRD2, DRD1 DRD4 1/4885GAA 762/4885MEN1 4880/4885

“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.