SCHEMBL3845810

SCHEMBL3845810

CO[Ti]c1c(C2=C(C)C(C)=CC2C)ccc2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
Hydrochloric Acid SCHEMBL3840923 0.85
Hydrochloric Acid SCHEMBL3850335 0.82
SCHEMBL3211136 0.74 ALDH1A1 (0.38) MAPTMEN1ALDH1A1KMT2A
SCHEMBL3842019 0.74 MAPT (0.36) MAPT
SCHEMBL3200449 0.73 HPGD (0.36) MAPTMEN1ALDH1A1RAB9AKMT2A
SCHEMBL3201831 0.73 KDM4E (0.36) MAPTMEN1ALDH1A1KMT2A
SCHEMBL3845808 0.73 KDM4E (0.31) MAPTMEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL3199294 0.72 DNMT1 (0.33) MEN1KMT2A
SCHEMBL3212142 0.72 CYP1A2 (0.30)
Hydrochloric Acid SCHEMBL3193464 0.72 KDM4E (0.32) MAPTMEN1ALDH1A1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426379-B1 TRANSITION METAL COMPLEX,CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER WITH THE SAME SUMITOMO CHEMICAL CO (JP) 2009-11-11 EP disclosed