SCHEMBL12379813

SCHEMBL12379813

C=CCOc1ccc(-c2ccc(-c3ccc(C)cc3)c(F)c2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.41
MGAM O43451 3/20 0.41
SI P14410 3/20 0.41
MGAM2 Q2M2H8 3/20 0.41
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CYP2D6 P10635 1/20 0.40
MAOB P27338 4/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
MAOA P21397 3/20 0.39

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
SCHEMBL12379809 0.89 GAA (0.41) GAAMGAMSIMGAM2MAPT
SCHEMBL4400187 0.88 GAA (0.40) GAAMGAMSIMGAM2MAPT
SCHEMBL12740598 0.86 FFAR1 (0.42) GAAMGAMSIMGAM2MAPT
SCHEMBL12172444 0.86 HTR2C (0.39) GAAMGAMSIMGAM2MAPT
SCHEMBL19392375 0.85 CA12 (0.49) GAAMGAMSIMGAM2MAPT
SCHEMBL12737138 0.84 FFAR1 (0.41) GAAMGAMSIMGAM2MAPT
SCHEMBL16247700 0.84 MAPT (0.42) GAAMGAMSIMGAM2MAPT
SCHEMBL12737044 0.84 FFAR1 (0.40) GAAMGAMSIMGAM2MAPT
SCHEMBL12740502 0.84 FFAR1 (0.40) GAAMGAMSIMGAM2MAPT
SCHEMBL472078 0.83 CA12 (0.53) GAAMAPTSMN1; SMN2MEN1LMNA

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
US-9093643-B2 Deformable material and actuator SEIKO EPSON CORPORATION (JP) 2015-07-28 US disclosed
US-8436117-B2 Stimuli responsive compound, stimuli responsive compound polymer, actuator and method for manufacturing stimuli responsive compound SEIKO EPSON CORPORATION (JP) 2013-05-07 US disclosed
US-20110196120-A1 STIMULI RESPONSIVE COMPOUND, STIMULI RESPONSIVE COMPOUND POLYMER, ACTUATOR AND METHOD FOR MANUFACTURING STIMULI RESPONSIVE COMPOUND SEIKO EPSON CORPORATION (JP) 2011-08-11 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-20110196120-A1 STIMULI RESPONSIVE COMPOUND, STIMULI RESPONSIVE COMPOUND POLYMER, ACTUATOR AND METHOD FOR MANUFACTURING STIMULI RESPONSIVE COMPOUND PUF60, RPSA, RPS16 GAA 4278/4885MGAM 2704/4885SI 4402/4885

“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.