SCHEMBL17249688

SCHEMBL17249688

CCOC(=O)C(F)P(=O)(OC)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
CYP3A4 P08684 3/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
PPARD Q03181 1/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 2/20 0.35
CHRM1 P11229 1/20 0.35
ADORA1 P30542 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL365852 0.90 CYP3A4 (0.39) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL16761022 0.90 ALDH1A1 (0.42) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL16761024 0.81 CYP3A4 (0.41) ALDH1A1CYP3A4TSHRCYP2C9CYP2C19
SCHEMBL17228535 0.76 TSHR (0.42) CYP3A4TSHRTDP1CYP2C9CYP2C19
SCHEMBL10987006 0.76 ALDH1A1 (0.34) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL9067967 0.74 ALDH1A1 (0.41) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL8803824 0.74 CYP2D6 (0.41) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL9468717 0.74 CYP2D6 (0.44) ALDH1A1CYP3A4ALOX15TSHRTDP1
SCHEMBL13469072 0.74 ACHE (0.38) ALDH1A1CYP3A4TSHRCYP2C9CYP2C19
SCHEMBL16761019 0.74 TSHR (0.37) CYP3A4TSHRTDP1CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464081-B2 Pyrrolidine derivatives and their use as complement pathway modulators NOVARTIS AG (CH) 2016-10-11 US disclosed
US-9464081-B2 Pyrrolidine derivatives and their use as complement pathway modulators NOVARTIS AG (CH) 2016-10-11 US disclosed
US-20150322060-A1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS NOVARTIS AG (CH) 2015-11-12 US disclosed
US-20150322060-A1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS NOVARTIS AG (CH) 2015-11-12 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-20150322060-A1 PYRROLIDINE DERIVATIVES AND THEIR USE AS COMPLEMENT PATHWAY MODULATORS CFD, TFPI, CFB ALDH1A1 2685/4885CYP3A4 1520/4885ALOX15 439/4885

“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.