SCHEMBL12379811

SCHEMBL12379811

C=CCOc1ccc(-c2cc(F)c(-c3ccc(C)cc3)c(F)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.43
MAOA P21397 4/20 0.42
GAA P10253 4/20 0.42
MGAM O43451 3/20 0.42
SI P14410 3/20 0.42
MGAM2 Q2M2H8 3/20 0.42
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 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
SCHEMBL12379815 0.90 MAOB (0.43) MAOBMAOAGAAMGAMSI
SCHEMBL12379812 0.85 MAOB (0.46) MAOBMAOAGAAMGAMSI
SCHEMBL12379810 0.85 MAOB (0.46) MAOBMAOAGAAMGAMSI
SCHEMBL19392375 0.84 CA12 (0.49) MAOBMAOAGAAMGAMSI
SCHEMBL472078 0.79 CA12 (0.53) GAAALDH1A1KDM4EMAPTMAPK1
SCHEMBL12379813 0.78 GAA (0.41) MAOBMAOAGAAMGAMSI
SCHEMBL17942997 0.78 ACHE (0.42) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL3158449 0.77 MAOB (0.38) MAOBMAOAGAAMGAMSI
SCHEMBL7860053 0.77 CA12 (0.42) MAOBMAOAGAAMGAMSI
SCHEMBL17775111 0.77 ACHE (0.54) MAPTMAPK1NPC1TP53RAB9A

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 MAOB 987/4885MAOA 1072/4885GAA 4278/4885

“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.