SCHEMBL1494415

SCHEMBL1494415

CC(C)(C)[SiH](N)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.36
SLC6A2 P23975 1/20 0.36
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C19 P33261 1/20 0.32
KCNN4 O15554 1/20 0.32
ALDH1A1 P00352 2/20 0.31
ALOX15 P16050 1/20 0.31
AKT1 P31749 1/20 0.31
AKT2 P31751 1/20 0.31
TSHR P16473 2/20 0.30
LMNA P02545 1/20 0.30
ALOX12 P18054 1/20 0.30
ACHE P22303 1/20 0.30
CYP3A4 P08684 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
PRMT1 Q99873 1/20 0.30
ESR1 P03372 2/20 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
SCHEMBL705029 0.74 MAPK1 (0.33) TAAR1SLC6A2MAPK1ALDH1A1ALOX15
SCHEMBL8381893 0.72 ALDH1A1 (0.37) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL18398 0.72 MAPK1 (0.36) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL3691011 0.72 MAPK1 (0.36) TAAR1SLC6A2MAPK1MAPTKMT2A
Hydrochloric Acid SCHEMBL1295227 0.70 MAPK1 (0.35) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL9499497 0.70 MAPK1 (0.35) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL30367101 0.70 MAPK1 (0.35) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL1494198 0.70 ALDH1A1 (0.37) TAAR1SLC6A2MAPK1MAPTKMT2A
Tert-Butylamine SCHEMBL28999847 0.70 TAAR1 (0.38) TAAR1SLC6A2MAPK1MAPTKMT2A
SCHEMBL2004810 0.69

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-8592544-B2 Polymeric compound containing metal complex residue and element comprising same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-11-26 US disclosed
US-20110124808-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-05-26 US disclosed
EP-2298828-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME Sumitomo Chemical Company, Limited (JP) 2011-03-23 EP 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-20110124808-A1 POLYMERIC COMPOUND CONTAINING METAL COMPLEX RESIDUE AND ELEMENT COMPRISING SAME ZRANB2, ZKSCAN2, SLC39A3 TAAR1 2612/4885SLC6A2 4689/4885MAPK1 2661/4885

“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.