SCHEMBL5736962

SCHEMBL5736962

C1=C(P(C2CCCCC2)C2CCCCC2)CCCC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.34
KDM1A O60341 1/20 0.31
NPC1 O15118 1/20 0.30
EPHX1 P07099 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL7463095 0.69 KDM1A (0.34) KDM1A
SCHEMBL6396884 0.66
SCHEMBL17258186 0.66
SCHEMBL15657725 0.62 ROCK2 (0.40)
SCHEMBL12902859 0.62 ROCK2 (0.32)
SCHEMBL23914201 0.62
SCHEMBL6682662 0.62 KDM1A (0.48) HSD11B1KDM1ANPC1EPHX1RAB9A
SCHEMBL235344 0.62 KDM1A (0.48) HSD11B1KDM1ANPC1EPHX1RAB9A
SCHEMBL123151 0.62 KDM1A (0.48) HSD11B1KDM1ANPC1EPHX1RAB9A
SCHEMBL20552191 0.62 KDM1A (0.48) HSD11B1KDM1ANPC1EPHX1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 CN claimed
EP-1680218-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS Promerus, LLC (US) 2006-07-19 EP claimed
WO-2005042147-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS PROMERUS, LLC (US) 2005-05-12 WO claimed
CN-101031595-A One-component cationic palladium pre-initiator for the latent polymerization of cycloolefins PROMERUS LLC (US) 2007-09-05 CN disclosed
EP-1680218-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS Promerus, LLC (US) 2006-07-19 EP disclosed
US-20050187398-A1 Single component cationic palladium proinitiators for the latent polymerization of cycloolefins PROMERUS, LLC 2005-08-25 US disclosed
WO-2005042147-A2 SINGLE COMPONENT CATIONIC PALLADIUM PROINITIATORS FOR THE LATENT POLYMERIZATION OF CYCLOOLEFINS PROMERUS, LLC (US) 2005-05-12 WO 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-20050187398-A1 Single component cationic palladium proinitiators for the latent polymerization of cycloolefins LRRK2, LBR, SNCA HSD11B1 4294/4885KDM1A 2422/4885NPC1 3795/4885

“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.