SCHEMBL9673128

SCHEMBL9673128

Cc1nn(C)c(Oc2ccc(F)cc2)c1C=O

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.74
CYP1A2 P05177 5/20 0.60
CYP2C19 P33261 5/20 0.60
CYP2C9 P11712 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.52
LMNA P02545 2/20 0.51
HTT P42858 3/20 0.46
MAPT P10636 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GAA P10253 2/20 0.44
CYP3A4 P08684 2/20 0.43
SCN4A P35499 1/20 0.40
FPR2 P25090 1/20 0.39
PROKR1 Q8TCW9 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL9673792 0.87 SMN1; SMN2 (0.76) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL2071589 0.85 SMN1; SMN2 (1.00) SMN1; SMN2CYP1A2CYP2C19CYP2C9LMNA
SCHEMBL13243006 0.85 SMN1; SMN2 (0.74) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL9672301 0.85 SMN1; SMN2 (0.74) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL13243011 0.84 SMN1; SMN2 (0.72) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL13243038 0.83 SMN1; SMN2 (0.67) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL9671184 0.82 SMN1; SMN2 (0.51) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL9672878 0.82 SMN1; SMN2 (0.51) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL9671187 0.82 SMN1; SMN2 (0.51) SMN1; SMN2CYP1A2CYP2C19CYP2C9L3MBTL1
SCHEMBL24162680 0.81 ALDH1A1 (0.56) SMN1; SMN2CYP1A2CYP2C19CYP2C9LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357226-A1 PREPARATION METHOD AND USE OF PYRAZOLE COMPOUND CONTAINING 1-(3,4-DIMETHOXYPHENYL)-BETA-CARBOLINE UNIT NANTONG UNIVERSITY (CN) 2023-11-09 US disclosed
US-20230357226-A1 PREPARATION METHOD AND USE OF PYRAZOLE COMPOUND CONTAINING 1-(3,4-DIMETHOXYPHENYL)-BETA-CARBOLINE UNIT NANTONG UNIVERSITY (CN) 2023-11-09 US disclosed
EP-0234045-B1 A PYRAZOLE OXIME DERIVATIVE AND ITS PRODUCTION AND USE NIHON NOHYAKU CO., LTD. (JP) 1992-09-02 EP disclosed
US-4843068-A INSECTICIDES, MITICIDES, FUNGICIDES NIHON NOHYAKU CO., LTD. (JP) 1989-06-27 US disclosed
EP-0234045-A2 A pyrazole oxime derivative and its production and use NIHON NOHYAKU CO., LTD. (JP) 1987-09-02 EP 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 (1 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-20230357226-A1 PREPARATION METHOD AND USE OF PYRAZOLE COMPOUND CONTAINING 1-(3,4-DIMETHOXYPHENYL)-BETA-CARBOLINE UNIT DDC, AADAC, CDK7 SMN1; SMN2 3362/4885CYP1A2 599/4885CYP2C19 425/4885

“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.