SCHEMBL9609729

SCHEMBL9609729

CCO[Si](CCC(O)CNCc1ccc2ccccc2c1)(OCC)OCC

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC5R P33032 4/20 0.41
MC4R P32245 3/20 0.41
IDO1 P14902 1/20 0.40
MC3R P41968 2/20 0.39
KDM1A O60341 1/20 0.39
MAPK1 P28482 2/20 0.39
CASR P41180 2/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
BCHE P06276 2/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACHE P22303 1/20 0.38
MC1R Q01726 1/20 0.38
ROCK1 Q13464 1/20 0.38
DNM1 Q05193 1/20 0.37

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
SCHEMBL9609708 0.80 DRD2 (0.42) MAPK1CYP1A2SMN1; SMN2
SCHEMBL9609730 0.80 CASR (0.47) CASRCYP1A2CYP2A6
SCHEMBL9609725 0.79 MC5R (0.57) MC5RMC4RIDO1MC3RMAPK1
SCHEMBL9609689 0.76 KDM4E (0.38) MEN1KMT2AMAPTSMN1; SMN2DNM1
SCHEMBL8140787 0.73 CYP1A2 (0.52) IDO1CYP1A2CYP2A6BCHE
SCHEMBL1285849 0.72 MC5R (0.50) MC5RMC4RIDO1MC3RMAPK1
SCHEMBL1703414 0.71 MC5R (0.49) MC5RMC4RIDO1MC3RMAPK1
SCHEMBL9609728 0.71 CNR2 (0.50) MC5RMC4RIDO1CASRMEN1
SCHEMBL9609688 0.71 ADRB2 (0.58) MAPTSMN1; SMN2
SCHEMBL29286777 0.70 MC5R (0.57) MC5RMC4RIDO1MC3RMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921243-B2 Fabrics comprising a photocatalyst to produce singlet oxygen from ambient oxygen VENTANA RESEARCH CORPORATION 2014-12-30 US disclosed
US-8481446-B2 Chemically-resistant coating composition VENTANA RESEARCH CORPORATION 2013-07-09 US disclosed
US-20120135651-A1 Fabrics Comprising a Photocatalyst to Produce Singlet Oxygen from Ambient Oxygen VENTANA RESEARCH CORPORATION 2012-05-31 US disclosed
US-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION VENTANA RESEARCH CORPORATION 2010-11-04 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-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION DNMT1, VCL, DNMT3L MC5R 4767/4885MC4R 4396/4885IDO1 3759/4885

“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.