SCHEMBL20775210

SCHEMBL20775210

CCOC(=O)C(C#N)=CNc1ccc(F)c(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
ALDH1A1 P00352 10/20 0.60
KDM4E B2RXH2 7/20 0.60
HPGD P15428 3/20 0.60
GAA P10253 2/20 0.60
MAPT P10636 6/20 0.59
DHODH Q02127 2/20 0.58
PKM P14618 1/20 0.53
HTT P42858 1/20 0.53
GLA P06280 1/20 0.52
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RXFP1 Q9HBX9 2/20 0.49
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.44

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
SCHEMBL20775209 1.00 NPSR1 (0.61) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4724693 0.89 ALDH1A1 (0.67) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL4724694 0.89 ALDH1A1 (0.67) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14314065 0.89 ALDH1A1 (0.67) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL31506299 0.88 ALDH1A1 (0.56) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL18988001 0.85 DHODH (0.60) NPSR1ALDH1A1KDM4EHPGDGAA
SCHEMBL13915762 0.83 NPSR1 (0.60) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL22602175 0.81 ALDH1A1 (0.58) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL28882654 0.80 ALDH1A1 (0.68) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL2062533 0.80 DHODH (0.60) NPSR1NPC1RAB9ASMN1; SMN2ALDH1A1

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-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ABBVIE INC (US) 2023-06-15 US disclosed
US-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ABBVIE INC (US) 2023-06-15 US disclosed
US-20200291024-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ABBVIE INC (US) 2020-09-17 US disclosed
EP-3676254-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF AbbVie Inc. (US) 2020-07-08 EP disclosed
CN-111315723-A Extramembranous nucleotide pyrophosphatase-phosphodiesterase 1(ENPP-1) inhibitor and application thereof 艾伯维公司 2020-06-19 CN disclosed
WO-2019046778-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF MAVUPHARMA, INC. (US) 2019-03-07 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 (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-20200291024-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, STING1 NPSR1 3423/4885NPC1 3280/4885RAB9A 1115/4885
US-20230183239-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE 1 (ENPP-1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, STING1 NPSR1 3423/4885NPC1 3280/4885RAB9A 1115/4885

“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.