SCHEMBL22900019

SCHEMBL22900019

CCNC(=O)CC(C)(C)S

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.41
FAAH O00519 1/20 0.40
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
KMT2A Q03164 2/20 0.33
RAB9A P51151 2/20 0.33
CAPN1 P07384 1/20 0.32
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
NPC1 O15118 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL929623 0.81 HPGD (0.32) HPGDRECQL
SCHEMBL1515360 0.80 HPGD (0.46) MCL1FAAHMMP1MMP2MMP3
SCHEMBL7094591 0.79 ALDH1A1 (0.43) FAAHKMT2AHPGDRECQLMEN1
SCHEMBL21516603 0.78 PIK3CD (0.48) MCL1FAAHMMP1MMP2MMP3
SCHEMBL931025 0.77 HDAC3 (0.38) KMT2AHPGDMEN1
SCHEMBL6377394 0.77 MCL1 (0.39) MCL1FAAHMMP1MMP2MMP3
SCHEMBL18965092 0.77 FAAH (0.47) MCL1FAAHMMP1MMP2MMP3
SCHEMBL23505924 0.76 MCL1 (0.41) MCL1FAAHMMP1MMP2MMP3
SCHEMBL1515359 0.76 MCL1 (0.41) MCL1FAAHMMP1MMP2MMP3
SCHEMBL20290710 0.76 MCL1 (0.41) MCL1FAAHMMP1MMP2MMP3

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-20230151006-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2023-05-18 US disclosed
US-20210017168-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2021-01-21 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-20230151006-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR GRIN2B, GRIN2A, GRIN3A MCL1 4161/4885FAAH 1723/4885MMP1 4748/4885
US-20210017168-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS GRIN2B, GRIN2A, GRIN3A MCL1 4067/4885FAAH 1654/4885MMP1 4805/4885

“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.