SCHEMBL20076415

SCHEMBL20076415

CCCCCCCCCCN(CC)CC(C)C

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.50
PLA2G2A P14555 1/20 0.50
DNM1 Q05193 4/20 0.48
KCNH2 Q12809 13/20 0.43
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL15384677 1.00 PLA2G1B (0.50) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL23846697 1.00 PLA2G1B (0.50) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL15186998 0.98 PLA2G1B (0.47) PLA2G1BPLA2G2ADNM1KCNH2
SCHEMBL9807746 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL10411256 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL17526607 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL19333372 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL9807760 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL10712988 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR
SCHEMBL10712630 0.91 DNM1 (0.52) PLA2G1BPLA2G2ADNM1KCNH2TSHR

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-10647747-B2 Cyclosporin derivatives and uses thereof S&T GLOBAL INC. (US) 2020-05-12 US disclosed
US-20180105558-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF S&T GLOBAL INC. 2018-04-19 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-10647747-B2 Cyclosporin derivatives and uses thereof FKBP5, FKBP1B, MALT1 PLA2G1B 4676/4885PLA2G2A 4850/4885DNM1 3114/4885
US-20180105558-A1 NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF FKBP1B, MALT1, FKBP5 PLA2G1B 4667/4885PLA2G2A 4836/4885DNM1 3016/4885

“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.