SCHEMBL6406592

SCHEMBL6406592

C1=C(C2CC3CCC2C3)c2ccccc2C1CC1C=C(C2CC3CCC2C3)c2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC6A3 Q01959 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6408453 0.77 SLC6A3 (0.34) MEN1POLBGAAKMT2ASLC6A3
Hydrochloric Acid SCHEMBL6401099 0.76 MEN1 (0.33) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL6403882 0.75 MEN1 (0.32) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL6401595 0.74 MEN1 (0.31) MEN1POLBGAAKMT2A
SCHEMBL6406550 0.74 PTPN1 (0.33) CYP1A2CYP2D6
Hydrochloric Acid SCHEMBL6408039 0.73 SLC6A3 (0.34) MEN1POLBGAAKMT2ASLC6A3
SCHEMBL9467530 0.73 MEN1 (0.47) MEN1POLBGAAKMT2ASLC6A3
Hydrochloric Acid SCHEMBL6408025 0.72 MEN1 (0.30) MEN1POLBGAAKMT2A
Hydrochloric Acid SCHEMBL6400795 0.71
SCHEMBL6406800 0.71 PTPN1 (0.41) CYP1A2CYP2D6

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-6844288-B2 Process for the preparation of ligands for metallogene catalysts BASELL POLYOLEFINE GMBH (DE) 2005-01-18 US disclosed
US-20030158356-A1 Process for the preparation of substantially amorphous alpha-olefin polymers and compositions containing them and process for the preparation of bridged ligand EQUISTAR CHEMICALS, LP 2003-08-21 US disclosed
US-20020169260-A1 Process for the preparation of ligands for metallocene catalysts RESCONI LUIGI (IT) 2002-11-14 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-20030158356-A1 Process for the preparation of substantially amorphous alpha-olefin polymers and compositions containing them and process for the preparation of bridged ligand MACF1, SDC1, SDC2 MEN1 3563/4885POLB 614/4885GAA 4214/4885
US-20020169260-A1 Process for the preparation of ligands for metallocene catalysts SDC1, SDC2, SDC4 MEN1 2357/4885POLB 346/4885GAA 4442/4885

“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.