SCHEMBL30734372

SCHEMBL30734372

O=C1C2C3C=C[C@H](C3)C2C(=O)N1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
TDP1 Q9NUW8 1/20 1.00
SMN1; SMN2 Q16637 5/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
RAB9A P51151 2/20 0.53
HTT P42858 3/20 0.53
USP2 O75604 3/20 0.53
TSHR P16473 2/20 0.53
HSD17B10 Q99714 2/20 0.53
RECQL P46063 2/20 0.52
LMNA P02545 1/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 2/20 0.47
PKM P14618 1/20 0.46
POLB P06746 1/20 0.45
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
MAPT P10636 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
SCHEMBL29900107 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL22922483 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL6052 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL18049094 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL18386589 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL525258 1.00 ALDH1A1 (1.00) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL31289550 0.86 ALDH1A1 (0.75) ALDH1A1TDP1SMN1; SMN2L3MBTL1KMT2A
Toluene SCHEMBL29171791 0.84 ALDH1A1 (0.70) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL28408842 0.80 ALDH1A1 (0.64) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1
SCHEMBL16592563 0.78 ALDH1A1 (0.64) ALDH1A1TDP1SMN1; SMN2L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388762-A1 ANTIBACTERIAL COATING LUXEMBOURG INST SCIENCE & TECH LIST (LU) 2025-12-25 US disclosed
EP-4551656-A1 ANTIBACTERIAL COATING LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2025-05-14 EP disclosed
US-11981816-B2 Rubber composition with dual fillers reinforcement THE GOODYEAR TIRE & RUBBER COMPANY (US) 2024-05-14 US disclosed
US-20240043663-A1 RUBBER COMPOSITION WITH DUAL FILLERS REINFORCEMENT LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LU) 2024-02-08 US disclosed
EP-4311688-A1 RUBBER COMPOSITION WITH DUAL FILLERS REINFORCEMENT The Goodyear Tire & Rubber Company (US) 2024-01-31 EP disclosed
WO-2024008848-A1 ANTIBACTERIAL COATING LUXEMBOURG INSTITUTE OF SCIENCE AND TECHNOLOGY (LIST) (LU) 2024-01-11 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-20250388762-A1 ANTIBACTERIAL COATING HLCS, DDC, PBDC1 ALDH1A1 219/4885TDP1 2433/4885SMN1; SMN2 4560/4885

“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.