SCHEMBL24322830

SCHEMBL24322830

CC(C)C(C(=O)NC1CCCCC1)N(C[C@H]1CCCO1)C(=O)CN

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 2/20 0.48
TSHR P16473 4/20 0.45
HSD17B10 Q99714 1/20 0.45
HTT P42858 2/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 2/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.37
RAB9A P51151 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
SCHEMBL24324220 0.99 ALDH1A1 (0.46) ALDH1A1KDM4ETSHRHSD17B10HTT
SCHEMBL24322682 0.84 ALDH1A1 (0.59) ALDH1A1KDM4ETSHRHSD17B10HTT
SCHEMBL24323711 0.84 MEN1 (0.46) HTTHPGDMEN1KMT2APOLB
SCHEMBL24322430 0.83 ALDH1A1 (0.60) ALDH1A1KDM4ETSHRHSD17B10HTT
SCHEMBL24323723 0.72 TSHR (0.54) ALDH1A1KDM4ETSHRHSD17B10HTT
SCHEMBL24322641 0.70 MEN1 (0.49) HTTHPGDMEN1KMT2APOLB
SCHEMBL16602523 0.63 SMN1; SMN2 (0.42) ALDH1A1KDM4ETSHRHPGDKMT2A
SCHEMBL12184848 0.63 LMNA (0.41) ALDH1A1KDM4EHSD17B10HTTMEN1
SCHEMBL18629495 0.62 POLB (0.51) ALDH1A1KDM4ETSHRHSD17B10POLB
SCHEMBL12311005 0.62 EPHX1 (0.50) ALDH1A1KDM4ETSHRHSD17B10HTT

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 ALDH1A1 4556/4885KDM4E 4426/4885TSHR 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.