SCHEMBL18307752

SCHEMBL18307752

CC(C)P(=O)(O)OCc1cccnc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.53
BTN3A1 O00481 1/20 0.48
PDE3A Q14432 1/20 0.48
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
GPR132 Q9UNW8 1/20 0.44
PKM P14618 1/20 0.43
KMT2A Q03164 1/20 0.43
GAA P10253 2/20 0.43
TBXAS1 P24557 1/20 0.43
NAPRT Q6XQN6 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HDAC1 Q13547 1/20 0.42

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
SCHEMBL20822105 0.90 FDPS (0.47) FDPSBTN3A1PDE3APOLBHPGD
SCHEMBL17034259 0.83 FDPS (0.53) FDPSBTN3A1PDE3AGAANAPRT
SCHEMBL207656 0.82 FDPS (0.56) FDPSBTN3A1PDE3AKMT2AGAA
SCHEMBL30102567 0.82 FDPS (0.56) FDPSBTN3A1PDE3AKMT2AGAA
SCHEMBL8394763 0.81 FDPS (0.54) FDPSBTN3A1PDE3AKMT2AGAA
SCHEMBL18307755 0.80 TSHR (0.63) NPSR1
SCHEMBL18307753 0.79 FDPS (0.43) FDPSBTN3A1PDE3APOLBHPGD
SCHEMBL19353248 0.79 FDPS (0.35) FDPSBTN3A1PDE3APOLBHPGD
SCHEMBL207655 0.79 FDPS (0.50) FDPSBTN3A1PDE3ANAPRTHDAC1
SCHEMBL11952576 0.78 FDPS (0.48) FDPSBTN3A1PDE3AGAANAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10301336-B2 Phosphonate compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2019-05-28 US disclosed
US-20170260219-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-09-14 US disclosed
US-20170260219-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2017-09-14 US disclosed
US-9663543-B2 Phosphonate compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-9663543-B2 Phosphonate compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20160362432-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 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 (3 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-20160362432-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, CFH, TFPI FDPS 152/4885BTN3A1 3529/4885PDE3A 2800/4885
US-10301336-B2 Phosphonate compounds for treatment of complement mediated disorders CFD, TFPI, C1QBP FDPS 539/4885BTN3A1 2837/4885PDE3A 3443/4885
US-20170260219-A1 PHOSPHONATE COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, TFPI, C1QBP FDPS 539/4885BTN3A1 2837/4885PDE3A 3443/4885

“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.