SCHEMBL24870746

SCHEMBL24870746

Cc1cc(N)ccc1C(=O)NCCOCCN

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.44
HTT P42858 1/20 0.44
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
CRBN Q96SW2 1/20 0.42
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
HPGD P15428 3/20 0.40
ALDH1A1 P00352 2/20 0.40
TP53 P04637 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
CA2 P00918 2/20 0.39
HTR2A P28223 1/20 0.39
ALOX15 P16050 1/20 0.38
ESRRB O95718 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
SCHEMBL22123577 0.90 SMN1; SMN2 (0.45) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24939964 0.89 SMN1; SMN2 (0.44) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24916559 0.89 SMN1; SMN2 (0.44) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24870886 0.89 SMN1; SMN2 (0.44) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24916632 0.88 SMN1; SMN2 (0.43) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL14280004 0.86 ALOX15 (0.50) SMN1; SMN2HTTNPC1RAB9AHPGD
SCHEMBL24870817 0.86 SMN1; SMN2 (0.41) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24916917 0.85 SMN1; SMN2 (0.43) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24916567 0.85 SMN1; SMN2 (0.40) SMN1; SMN2HTTHDAC3HDAC1CRBN
SCHEMBL24870859 0.84 SMN1; SMN2 (0.42) SMN1; SMN2HTTHDAC3HDAC1CRBN

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-20230022724-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-26 US disclosed
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 US disclosed
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 US disclosed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 US disclosed
US-20230011869-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 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 (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-20230022724-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 SMN1; SMN2 1951/4885HTT 4279/4885HDAC3 981/4885
US-20230011869-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 SMN1; SMN2 1951/4885HTT 4279/4885HDAC3 981/4885
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 SMN1; SMN2 2011/4885HTT 4263/4885HDAC3 992/4885
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES IL4, RPS4Y1, RPS4X SMN1; SMN2 2453/4885HTT 4349/4885HDAC3 903/4885
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 SMN1; SMN2 1986/4885HTT 4404/4885HDAC3 953/4885

“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.