SCHEMBL5815928

SCHEMBL5815928

COc1ccc(C(N)=O)c(N)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 4/20 0.69
POLB P06746 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GLA P06280 1/20 0.49
GAA P10253 1/20 0.49
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
IKBKB O14920 1/20 0.42
PDE10A Q9Y233 1/20 0.41
PLAU P00749 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41
JAK2 O60674 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL30940155 0.85 TDP1 (0.66) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL21339634 0.85 TDP1 (0.66) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL23797063 0.84 NNMT (0.53) NNMTPOLBTDP1KDM4EHPGD
Hydrochloric Acid SCHEMBL20552328 0.84 TDP1 (0.64) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL5010608 0.81 POLB (0.71) NNMTPOLBTDP1HPGDALDH1A1
SCHEMBL29421563 0.81 NNMT (1.00) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL6309037 0.81 NNMT (1.00) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL31069780 0.80 NNMT (0.67) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL6305051 0.80 NNMT (0.67) NNMTPOLBTDP1KDM4EHPGD
SCHEMBL3543895 0.76 NNMT (0.61) NNMTPOLBTDP1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240247015-A1 PHOSPHORUS DERIVATIVES AS NOVEL SOS1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-07-25 US disclosed
EP-4322962-A1 PHOSPHORUS DERIVATIVES AS NOVEL SOS1 INHIBITORS Bayer Aktiengesellschaft (DE) 2024-02-21 EP disclosed
CN-117500507-A Phosphorus derivatives as novel SOS1 inhibitors 拜耳公司 2024-02-02 CN disclosed
US-20230357239-A1 PYRIDO[2,3-D]PYRIMIDIN-4-AMINES AS SOS1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 US disclosed
EP-4214204-A1 PYRIDO[2,3-D]PYRIMIDIN-4-AMINES AS SOS1 INHIBITORS Bayer Aktiengesellschaft (DE) 2023-07-26 EP disclosed
CN-116323623-A Pyrido [2,3-d ] pyrimidin-4-amines as SOS1 inhibitors 拜耳公司 2023-06-23 CN disclosed
WO-2022219035-A1 PHOSPHORUS DERIVATIVES AS NOVEL SOS1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-10-20 WO disclosed
WO-2022058344-A1 PYRIDO[2,3-D]PYRIMIDIN-4-AMINES AS SOS1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-03-24 WO disclosed
WO-2006112828-A1 AZAINDOLE DERIVATIVES AS INHIBITORS OF P38 KINASE SCIOS, INC. (US) 2006-10-26 WO disclosed
US-20050288299-A1 Azaindole derivatives as inhibitors of p38 kinase SCIOS INC. 2005-12-29 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-20230357239-A1 PYRIDO[2,3-D]PYRIMIDIN-4-AMINES AS SOS1 INHIBITORS SOS1, PPM1D, SOS2 NNMT 1831/4885POLB 884/4885TDP1 205/4885
US-20240247015-A1 PHOSPHORUS DERIVATIVES AS NOVEL SOS1 INHIBITORS SOST, PPM1D, SOS1 NNMT 4678/4885POLB 1700/4885TDP1 947/4885
US-20050288299-A1 Azaindole derivatives as inhibitors of p38 kinase MAPKAPK2, MAPK1, MAPK3 NNMT 964/4885POLB 2004/4885TDP1 1225/4885

“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.