SCHEMBL31369640

SCHEMBL31369640

N[C@@H]1CCCC[C@@H]1CCC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A12 P48065 3/20 0.40
SLC6A11 P48066 3/20 0.40
SLC6A13 Q9NSD5 3/20 0.40
ALDH1A1 P00352 2/20 0.37
FOLH1 Q04609 1/20 0.37
THRB P10828 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 2/20 0.35
HSD17B10 Q99714 2/20 0.34
CYP2C9 P11712 1/20 0.34
NR1I2 O75469 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
ACHE P22303 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
PMP22 Q01453 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10341378 1.00 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL2498681 1.00 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
Hydrochloric Acid SCHEMBL10611230 0.98 SLC6A12 (0.42) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
Hydrochloric Acid SCHEMBL10611236 0.98 SLC6A12 (0.42) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL31370455 0.96 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL31369811 0.96 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL28554276 0.96 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL31369974 0.96 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
SCHEMBL31370503 0.96 SLC6A12 (0.40) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1
Hydrochloric Acid SCHEMBL10611644 0.94 SLC6A12 (0.42) SLC6A12SLC6A11SLC6A13ALDH1A1FOLH1

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 SLC6A12 1985/4885SLC6A11 2621/4885SLC6A13 2057/4885

“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.