SCHEMBL24323723

SCHEMBL24323723

NCC(=O)N(CC(=O)NC1CCCC1)C[C@H]1CCCO1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
GAA P10253 1/20 0.54
LMNA P02545 2/20 0.53
KDM4E B2RXH2 5/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 4/20 0.48
NPC1 O15118 3/20 0.48
MEN1 O00255 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
RAB9A P51151 2/20 0.48
MAPK1 P28482 2/20 0.48
MITF O75030 1/20 0.48
MAPT P10636 1/20 0.48
PKM P14618 1/20 0.48
AGTR1 P30556 1/20 0.48
ATM Q13315 1/20 0.48
TLR9 Q9NR96 1/20 0.48
HPGD P15428 2/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 3/20 0.41

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 0.73 ALDH1A1 (0.46) TSHRGAALMNAKDM4EKMT2A
SCHEMBL24322830 0.72 ALDH1A1 (0.48) TSHRGAALMNAKDM4EKMT2A
SCHEMBL24322430 0.72 ALDH1A1 (0.60) TSHRGAALMNAKDM4EKMT2A
SCHEMBL24322682 0.71 ALDH1A1 (0.59) TSHRGAALMNAKDM4EKMT2A
SCHEMBL15866467 0.68 HPGD (0.58) TSHRLMNAKMT2AALDH1A1NPC1
SCHEMBL14748210 0.68 HPGD (0.58) TSHRLMNAKMT2AALDH1A1NPC1
SCHEMBL991938 0.66 SMN1; SMN2 (0.61) LMNAKDM4EKMT2AALDH1A1NPC1
SCHEMBL23475863 0.65 EPHX1 (0.61) LMNAKDM4EKMT2AALDH1A1NPC1
SCHEMBL22546754 0.65 EPHX1 (0.61) LMNAKDM4EKMT2AALDH1A1NPC1
Hydrochloric Acid SCHEMBL3512220 0.65 SMN1; SMN2 (0.59) LMNAKDM4EKMT2AALDH1A1NPC1

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 TSHR 1902/4885GAA 1981/4885LMNA 1889/4885

“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.