SCHEMBL3356600

SCHEMBL3356600

CCCCC1CCC(C(=O)Oc2ccc(/C=C/C(=O)O)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
ATM Q13315 1/20 0.45
F2 P00734 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ELANE P08246 1/20 0.41
HPGD P15428 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
AKR1C3 P42330 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
PGR P06401 1/20 0.38

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
SCHEMBL3356608 1.00 THRB (0.45) THRBATMF2SMN1; SMN2HTT
SCHEMBL18406245 0.97 THRB (0.44) THRBATMF2SMN1; SMN2HTT
SCHEMBL3358506 0.97 THRB (0.44) THRBATMF2SMN1; SMN2HTT
SCHEMBL3358513 0.97 THRB (0.44) THRBATMF2SMN1; SMN2HTT
SCHEMBL3357820 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT
SCHEMBL3356143 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT
SCHEMBL3356133 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT
SCHEMBL3357665 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT
SCHEMBL3357812 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT
SCHEMBL3357673 0.95 THRB (0.43) THRBATMF2SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10208031-B2 Photocrosslinkable materials comprising alicyclic group ROLIC AG (CH) 2019-02-19 US disclosed
US-9765235-B2 Photoaligning material ROLIC AG (CH) 2017-09-19 US disclosed
EP-2152660-B1 PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP ROLIC AG (CH) 2016-05-11 EP disclosed
US-20140162076-A1 PHOTOALIGNING MATERIAL ROLIC AG (CH) 2014-06-12 US disclosed
US-20100048849-A1 PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP ROLIC AG (CH) 2010-02-25 US disclosed
EP-2152660-A2 PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP Rolic AG (CH) 2010-02-17 EP disclosed
WO-2008145225-A2 PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP ROLIC AG (CH) 2008-12-04 WO 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 (2 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-10208031-B2 Photocrosslinkable materials comprising alicyclic group DDC, ALAD, DYNC1LI1 THRB 4854/4885ATM 2265/4885F2 963/4885
US-20100048849-A1 PHOTOCROSSLINKABLE MATERIALS COMPRISING ALICYCLIC GROUP DDC, ALAD, DYNC1LI1 THRB 4854/4885ATM 2265/4885F2 963/4885

“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.