SCHEMBL20524263

SCHEMBL20524263

CCOP(=O)(CSC(=N)N)OCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 4/20 0.43
TSHR P16473 3/20 0.43
NOS3 P29474 3/20 0.43
NOS2 P35228 3/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 1/20 0.43
PPARD Q03181 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
BLM P54132 1/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH4 Q9H3N8 2/20 0.36
IDO1 P14902 2/20 0.33
TP53 P04637 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
Bromide SCHEMBL31738696 0.79 PPARD (0.47) NOS1TSHRNOS3NOS2CYP1A2
SCHEMBL23270437 0.79 MAPT (0.49) TSHRCYP1A2CYP2D6TDP1MAPT
SCHEMBL7972024 0.75 TSHR (0.46) TSHRPPARDTDP1MAPTTP53
Diethyl Hydrogen Phosphate SCHEMBL2788463 0.74 NOS3 (0.58) NOS1TSHRNOS3NOS2CYP1A2
Diethyl Hydrogen Phosphate SCHEMBL28772823 0.71 NOS3 (0.52) NOS1TSHRNOS3NOS2CYP1A2
SCHEMBL4367124 0.69 NOS1 (0.42) NOS1TSHRNOS3NOS2CYP1A2
SCHEMBL161140 0.69 TSHR (0.55) TSHRCYP2C19PPARDTDP1MEN1
SCHEMBL282085 0.68 TSHR (0.60) TSHRCYP2C19PPARDTDP1MEN1
SCHEMBL3485999 0.68 TSHR (0.60) TSHRCYP2C19PPARDTDP1MEN1
SCHEMBL3889468 0.67 TSHR (0.52) TSHRCYP2C19PPARDTDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12331068-B2 Compositions and methods for inhibiting CD73 PELOTON THERAPEUTICS, INC. (US) 2025-06-17 US disclosed
EP-3810109-B1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING CD73 PELOTON THERAPEUTICS INC (US) 2024-08-07 EP disclosed
US-11591355-B2 CD73 inhibitors and uses thereof PELOTON THERAPEUTICS INC. (US) 2023-02-28 US disclosed
US-20210317150-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS, INC. (US) 2021-10-14 US disclosed
US-20210253614-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 PELOTON THERAPEUTICS, INC. (US) 2021-08-19 US disclosed
US-20210253614-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 PELOTON THERAPEUTICS, INC. (US) 2021-08-19 US disclosed
EP-3810109-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 Peloton Therapeutics, Inc. (US) 2021-04-28 EP disclosed
US-20200115404-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS INC. 2020-04-16 US disclosed
US-20200115404-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS INC. 2020-04-16 US disclosed
EP-3600273-A1 CD73 INHIBITORS AND USES THEREOF Peloton Therapeutics, Inc. (US) 2020-02-05 EP disclosed
WO-2018183635-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS, INC. (US) 2018-10-04 WO 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 (5 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-20210253614-A1 COMPOSITIONS AND METHODS FOR INHIBITING CD73 ENTPD5, NT5E, ENTPD1 NOS1 1868/4885TSHR 2778/4885NOS3 1688/4885
US-20200115404-A1 CD73 INHIBITORS AND USES THEREOF ENTPD5, ENTPD1, NT5E NOS1 1553/4885TSHR 1870/4885NOS3 1791/4885
US-12331068-B2 Compositions and methods for inhibiting CD73 ENTPD5, NT5E, ENTPD1 NOS1 1868/4885TSHR 2778/4885NOS3 1688/4885
US-11591355-B2 CD73 inhibitors and uses thereof ENTPD5, ENTPD1, ENTPD3 NOS1 1144/4885TSHR 986/4885NOS3 690/4885
US-20210317150-A1 CD73 INHIBITORS AND USES THEREOF ENTPD5, ENTPD1, NT5E NOS1 1553/4885TSHR 1870/4885NOS3 1791/4885

“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.