SCHEMBL30022993

SCHEMBL30022993

O=C(CCl)NCC(CO)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
ALDH1A1 P00352 2/20 0.55
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HPGD P15428 2/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 3/20 0.39
MCHR1 Q99705 2/20 0.38
PYGL P06737 1/20 0.38
CYP2D6 P10635 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KCNH2 Q12809 2/20 0.37
EPHX1 P07099 1/20 0.37
EPHX2 P34913 1/20 0.37
GSTO1 P78417 1/20 0.36

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
SCHEMBL30020420 0.82 HTT (0.57) HTTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL25834163 0.77 S1PR3 (0.42) HTTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL5866353 0.73 MCHR1 (0.44) HTTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL7046825 0.73 MCHR1 (0.44) HTTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL759261 0.71 SLC6A4 (0.49) HTTALDH1A1LMNASMN1; SMN2CYP3A4
SCHEMBL30022845 0.71 SLC6A2 (0.43) HTTALDH1A1LMNASMN1; SMN2CYP3A4
SCHEMBL23716319 0.70 HPGD (0.59) HTTHPGDPOLBEPHX2
SCHEMBL8312188 0.70 MCHR1 (0.42) HTTALDH1A1LMNASMN1; SMN2HPGD
SCHEMBL5866425 0.69 NPC1 (0.49) HTTSMN1; SMN2HPGDPOLBMCHR1
SCHEMBL6161768 0.69 NPC1 (0.49) HTTSMN1; SMN2HPGDPOLBMCHR1

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-20240270705-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE VIVIDION THERAPEUTICS, INC. 2024-08-15 US disclosed
WO-2022251280-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE VIVIDION THERAPEUTICS, INC. (US) 2022-12-01 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 (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-20240270705-A1 COMPOUNDS SELECTIVE FOR JAK1 AND METHODS OF USE JAK2, JAK1, JAK3 HTT 2172/4885ALDH1A1 2223/4885LMNA 4467/4885

“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.