SCHEMBL9609685

SCHEMBL9609685

CCO[Si](CCCSCC(=O)c1ccc2ccccc2c1)(OCC)OCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
NPC1 O15118 5/20 0.46
RAB9A P51151 5/20 0.46
KMT2A Q03164 2/20 0.46
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
GAA P10253 1/20 0.45
HSP90AA1 P07900 1/20 0.44
MAPT P10636 6/20 0.43
LMNA P02545 3/20 0.43
CDC7 O00311 1/20 0.43
POLB P06746 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 2/20 0.43
PTPN1 P18031 1/20 0.43
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 2/20 0.42
HCRTR1 O43613 1/20 0.42

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
SCHEMBL1472059 0.82 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL11952407 0.81 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL9609686 0.80 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL19698077 0.77 HRH3 (0.55) ALDH1A1SMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL9609727 0.76 CYP1A2 (0.42) SMN1; SMN2NPC1RAB9AMAPTLMNA
SCHEMBL3412375 0.75 HDAC1 (0.50) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL3378718 0.75 HDAC1 (0.50) ALDH1A1SMN1; SMN2NPC1RAB9AHPGD
SCHEMBL14398426 0.72 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL3381011 0.72 HDAC1 (0.71) HDAC1HDAC8HDAC3HDAC2
SCHEMBL7183359 0.71 PTPN1 (0.44) ALDH1A1SMN1; SMN2NPC1RAB9AKMT2A

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 ALDH1A1 1103/4885SMN1; SMN2 992/4885NPC1 1763/4885

“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.