SCHEMBL19082576

SCHEMBL19082576

C[SiH](C)C=CCNCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
ATM Q13315 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
PRMT1 Q99873 1/20 0.43
KCNH2 Q12809 2/20 0.42
IDO1 P14902 2/20 0.41
NPC1 O15118 1/20 0.41
KDM1A O60341 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 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
SCHEMBL19082578 0.82 MEN1 (0.47) SIGMAR1GAAMAPTCYP3A4MAOA
SCHEMBL20921313 0.80 SIGMAR1 (0.57) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL19082566 0.76 SIGMAR1 (0.47) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL4527790 0.76 GPR52 (0.50)
SCHEMBL28572073 0.75 PRMT1 (0.68) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL15571262 0.75 PRMT1 (0.68) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL7103008 0.74 SIGMAR1 (0.57) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL283735 0.72 SIGMAR1 (0.81) SIGMAR1GAAMAPTATMTAAR1
SCHEMBL252240 0.72 KCNH2 (0.56) SIGMAR1GAAMAPTATMTAAR1
Butane SCHEMBL11220425 0.71 SIGMAR1 (0.58) SIGMAR1GAAMAPTATMTAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190721-A1 ALKOXYSILYL-VINYLENE GROUP-CONTAINING SILICON COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-07-06 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 (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-20170190721-A1 ALKOXYSILYL-VINYLENE GROUP-CONTAINING SILICON COMPOUND VCAM1, VIM, ICAM1 SIGMAR1 1112/4885GAA 270/4885MAPT 3953/4885

“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.