SCHEMBL24322831

SCHEMBL24322831

O=C(NC[C@H]1CCCO1)[C@H]1CCCNC1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.52
PKM P14618 1/20 0.52
TSHR P16473 2/20 0.52
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TP53 P04637 1/20 0.49
ALOX12 P18054 1/20 0.49
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HTT P42858 1/20 0.47
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45

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
Hydrochloric Acid SCHEMBL21639935 0.88 HPGD (0.57) HPGDPKMTSHRUSP2SMN1; SMN2
SCHEMBL21680230 0.85 HPGD (0.53) HPGDPKMTSHRUSP2SMN1; SMN2
SCHEMBL24322667 0.85 MAPT (0.47) HPGDPKMTSHRSMN1; SMN2CYP2C9
Hydrochloric Acid SCHEMBL21640081 0.84 HPGD (0.52) HPGDPKMTSHRUSP2SMN1; SMN2
Hydrochloric Acid SCHEMBL21640726 0.84 HPGD (0.52) HPGDPKMTSHRUSP2SMN1; SMN2
SCHEMBL19254900 0.83 HPGD (0.65) HPGDPKMTSHRUSP2SMN1; SMN2
SCHEMBL19254902 0.83 HPGD (0.65) HPGDPKMTSHRUSP2SMN1; SMN2
Hydrochloric Acid SCHEMBL21640489 0.82 HPGD (0.53) HPGDPKMTSHRUSP2SMN1; SMN2
Hydrochloric Acid SCHEMBL29086095 0.80 HPGD (0.47) HPGDPKMTSHRUSP2SMN1; SMN2
SCHEMBL10030564 0.76 SLC6A1 (0.57) TSHRSMN1; SMN2KDM4EKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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 (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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN HPGD 1284/4885PKM 4535/4885TSHR 1902/4885

“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.