SCHEMBL8022153

SCHEMBL8022153

Cc1ccc(C2=Nc3ccccc3Sc3ccccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.46
RARA P10276 1/20 0.44
RARB P10826 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
DRD2 P14416 3/20 0.41
BCHE P06276 1/20 0.39
TRPA1 O75762 1/20 0.39
IDO1 P14902 1/20 0.38
CNR2 P34972 1/20 0.37
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CHRM1 P11229 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CHRM3 P20309 1/20 0.36
DRD1 P21728 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
SCHEMBL5443827 0.86 IDO1 (0.50) CNR1RARARARBRXRARXRB
SCHEMBL12912969 0.81 NPC1 (0.46) IDO1LMNANPC1MAPTRAB9A
SCHEMBL12912867 0.81 IDO1 (0.50) IDO1LMNANPC1MAPTRAB9A
SCHEMBL8022326 0.80 DRD2 (0.43) CNR1RARARARBRXRARXRB
SCHEMBL1366965 0.79 RARA (0.64) CNR1RARARARBRXRARXRB
SCHEMBL7954347 0.78 CNR1 (0.55) CNR1RARARARBRXRARXRB
SCHEMBL1366387 0.76 HDAC1 (0.63) CNR1RARARARBRXRARXRB
SCHEMBL85731 0.75 DRD2 (0.47) DRD2TRPA1LMNACHRM2HTR1A
SCHEMBL18088429 0.72 HDAC3 (0.59) RARARARBRXRARXRBRXRG
SCHEMBL28428006 0.71 ALDH1A1 (0.54) IDO1LMNANPC1MAPTRAB9A

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
WO-2008121415-A2 IMPROVED PROCESS FOR PREPARING QUETIAPINE FUMARATE TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-10-09 WO disclosed
US-20080241949-A1 Process for preparing quetiapine fumarate TEVA PHARMACEUTICAL INDUSTRIES LTD (IL) 2008-10-02 US disclosed
US-20080241949-A1 Process for preparing quetiapine fumarate TEVA PHARMACEUTICAL INDUSTRIES LTD (IL) 2008-10-02 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 (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-20080241949-A1 Process for preparing quetiapine fumarate CYP3A5, CYP3A4, FH CNR1 2336/4885RARA 3658/4885RARB 3364/4885

“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.