SCHEMBL2137371

SCHEMBL2137371

CCCCc1[c]ccc(F)c1CCCC

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TYR P14679 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GCGR P47871 1/20 0.30
SKP2 Q13309 1/20 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
SCHEMBL8106410 0.85
SCHEMBL430510 0.83 TYR (0.35) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL9486103 0.80 SMN1; SMN2 (0.35) HPGDSMN1; SMN2
SCHEMBL981990 0.80 TYR (0.38) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL815293 0.80 TYR (0.38) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL2967957 0.79 TYR (0.40) HTTTYRMEN1KMT2A
SCHEMBL984369 0.79 TYR (0.33) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL2972599 0.79 TYR (0.40) HTTTYRMEN1KMT2A
SCHEMBL815591 0.79 TYR (0.40) HTTTYRMEN1KMT2A
SCHEMBL2970338 0.79 TYR (0.40) HTTTYRMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1454931-B1 PROPYLENE BLOCK COPOLYMER JAPAN POLYPROPYLENE CORP (JP) 2018-01-24 EP disclosed
EP-2009017-B1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA -OLEFIN BLOCK COPOLYMER BY USING THE CATALYST JAPAN POLYPROPYLENE CORP (JP) 2013-06-26 EP disclosed
US-7906599-B2 Transition metal compound, catalyst for olefin polymerization containing the same, and method for producing propylene/ethylene-α-olefin block copolymer by using the catalyst JAPAN POLYPROPYLENE CORPORATION (JP) 2011-03-15 US disclosed
US-20090099310-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA-OLEFIN BLOCK COPOLYMER BY USING THE CATALYST JAPAN POLYPROPYLENE CORPORATION (JP) 2009-04-16 US disclosed
EP-2009017-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA -OLEFIN BLOCK COPOLYMER BY USING THE CATALYST Japan Polypropylene Corporation (JP) 2008-12-31 EP disclosed
US-6916886-B2 Propylene block copolymer JAPAN POLYPROPYLENE CORPORATION (JP) 2005-07-12 US disclosed
US-20050009993-A1 Propylene block copolymer JAPAN POLYPROPYLENE CORPORATION (JP) 2005-01-13 US disclosed
EP-1454931-A1 PROPYLENE BLOCK COPOLYMER Japan Polypropylene Corporation (JP) 2004-09-08 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-20090099310-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA-OLEFIN BLOCK COPOLYMER BY USING THE CATALYST ALOX12, ETFB, POF1B NPC1 3879/4885HPGD 325/4885MAPK1 1360/4885

“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.