SCHEMBL5393597

SCHEMBL5393597

CCCCCCCCCPCCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.50
KCNH2 Q12809 2/20 0.50
CETP P11597 1/20 0.47
DNM1 Q05193 2/20 0.44
HTR2A P28223 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TP53 P04637 2/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EPHX2 P34913 1/20 0.43
PKM P14618 1/20 0.43
HPGD P15428 1/20 0.42
HTT P42858 2/20 0.42
DRD2 P14416 1/20 0.42
OPRM1 P35372 1/20 0.42
DRD3 P35462 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL5393163 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5402039 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5380996 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5394940 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5389553 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5386068 1.00 SIGMAR1 (0.50) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5402052 0.98 SIGMAR1 (0.52) SIGMAR1KCNH2CETPDNM1HTR2A
SCHEMBL5391024 0.92 SIGMAR1 (0.48) SIGMAR1KCNH2CETPTP53SMN1; SMN2
SCHEMBL11236944 0.85 SIGMAR1 (0.51) SIGMAR1KCNH2OPRM1DRD3ADRA2A
SCHEMBL11428831 0.84 KCNH2 (0.49) SIGMAR1KCNH2MEN1KMT2AOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214747-B2 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-05-08 US disclosed
US-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. 2005-10-27 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 (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-20050239980-A1 Phosphorus substituted metallocene compounds for olefin polymerization CCRL2, ARL1, OSBP2 SIGMAR1 626/4885KCNH2 1401/4885CETP 2914/4885

“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.