SCHEMBL9918909

SCHEMBL9918909

CC(CC1CCC(OCC2CO2)CC1)C1CCC(OCC2CO2)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL9066827 0.81 HCRTR2 (0.39) SMN1; SMN2TSHRALDH1A1TDP1
SCHEMBL805166 0.81 TSHR (0.38) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL26938153 0.81 TSHR (0.38) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL7083176 0.77 TSHR (0.40) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL15683200 0.77 SMN1; SMN2 (0.38) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL733109 0.76 TSHR (0.50) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL285113 0.75 TSHR (0.41) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL9066859 0.75 SMN1; SMN2 (0.39) SMN1; SMN2TSHRALDH1A1TDP1MAPK1
SCHEMBL28385789 0.74
SCHEMBL2554864 0.74

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-2895570-A2 SILOXANE ORGANIC HYBRID MATERIALS PROVIDING FLEXIBILITY TO EPOXY-BASED COATING COMPOSITONS Momentive Performance Materials Inc. (US) 2015-07-22 EP claimed
WO-2014042944-A2 SILOXANE ORGANIC HYBRID MATERIALS PROVIDING FLEXIBILITY TO EPOXY-BASED COATING COMPOSITONS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2014-03-20 WO claimed
EP-2895570-A2 SILOXANE ORGANIC HYBRID MATERIALS PROVIDING FLEXIBILITY TO EPOXY-BASED COATING COMPOSITONS Momentive Performance Materials Inc. (US) 2015-07-22 EP disclosed
US-9000110-B2 Fluoroalkyl group-containing n-substituted (meth)acrylamide compound, polymer thereof, and use thereof AGC SEIMI CHEMICAL CO., LTD. (JP) 2015-04-07 US disclosed
WO-2014042944-A2 SILOXANE ORGANIC HYBRID MATERIALS PROVIDING FLEXIBILITY TO EPOXY-BASED COATING COMPOSITONS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2014-03-20 WO disclosed
US-20120149860-A1 FLUOROALKYL GROUP-CONTAINING N-SUBSTITUTED (METH)ACRYLAMIDE COMPOUND, POLYMER THEREOF , AND USE THEREOF AGC SEIMI CHEMICAL CO.,LTD. (JP) 2012-06-14 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-20120149860-A1 FLUOROALKYL GROUP-CONTAINING N-SUBSTITUTED (METH)ACRYLAMIDE COMPOUND, POLYMER THEREOF , AND USE THEREOF AFF2, AFF1, FRG1 SMN1; SMN2 3754/4885TSHR 2065/4885ALDH1A1 3201/4885

“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.