SCHEMBL5084805

SCHEMBL5084805

CC1=CCC(C)=C1C(c1ccccc1)C1c2ccccc2-c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
ATM Q13315 1/20 0.41
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
GPR3 P46089 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
SCHEMBL3157929 0.76 MEN1 (0.52) MEN1POLBKMT2AATMCYP1A2
SCHEMBL3157883 0.71 MEN1 (0.43) MEN1POLBKMT2AATMCYP1A2
SCHEMBL10455242 0.69 MEN1 (0.53) MEN1POLBKMT2AATMCYP1A2
Hydrochloric Acid SCHEMBL6557718 0.69 MEN1 (0.40) MEN1POLBKMT2AATMCYP1A2
SCHEMBL12814950 0.67 MEN1 (0.43) MEN1POLBKMT2AATMCYP1A2
SCHEMBL12815719 0.66 MEN1 (0.42) MEN1POLBKMT2AATMCYP1A2
SCHEMBL3919889 0.64 GPR3 (0.46) MEN1POLBKMT2AATMCYP1A2
SCHEMBL6675583 0.64 GPR3 (0.46) MEN1POLBKMT2AATMCYP1A2
Hydrochloric Acid SCHEMBL16457704 0.64 MEN1 (0.40) MEN1POLBKMT2AATMCYP1A2
SCHEMBL8824255 0.63 MEN1 (0.37) MEN1POLBKMT2AATMCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1532181-B1 FULVENE AND PREPARATION THEREOF LG CHEMICAL LTD (KR) 2016-03-16 EP disclosed
US-7439378-B2 Fulvene, metallocene catalysts and preparation method thereof, and preparation of polyolefines copolymer using the same LG CHEM, LTD. (KR) 2008-10-21 US disclosed
US-7271277-B2 Fulvene, metallocene catalysts and preparation method thereof, and preparation of polyolefines copolymer using the same LG CHEM, LTD. (KR) 2007-09-18 US disclosed
US-20070185291-A1 FULVENE, METALLOCENE CATALYSTS AND PREPARATION METHOD THEREOF, AND PREPARATION OF POLYOLEFINES COPOLYMER USING THE SAME LG CHEM, LTD. (KR) 2007-08-09 US disclosed
US-20050004385-A1 Fulvene, metallocene catalysts and preparation method thereof, and preparation of polyolefines copolymer using the same LG CHEM, LTD. (KR) 2005-01-06 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 (2 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-20050004385-A1 Fulvene, metallocene catalysts and preparation method thereof, and preparation of polyolefines copolymer using the same FDPS, GGPS1, CYP4F8 MEN1 1498/4885POLB 1965/4885KMT2A 2415/4885
US-20070185291-A1 FULVENE, METALLOCENE CATALYSTS AND PREPARATION METHOD THEREOF, AND PREPARATION OF POLYOLEFINES COPOLYMER USING THE SAME FDPS, GGPS1, CYP4F8 MEN1 1498/4885POLB 1965/4885KMT2A 2415/4885

“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.