SCHEMBL11285667

SCHEMBL11285667

CCOC(=O)CC(Br)CBr

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
TRPA1 O75762 1/20 0.54
GAA P10253 2/20 0.46
MGAM O43451 1/20 0.46
SI P14410 1/20 0.46
MGAM2 Q2M2H8 1/20 0.46
ALOX15 P16050 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HSD17B10 Q99714 2/20 0.39
CHRM1 P11229 1/20 0.39
ADORA1 P30542 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
CYP1A2 P05177 1/20 0.38
LMNA P02545 1/20 0.37
SOAT1 P35610 1/20 0.36

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
SCHEMBL6585676 0.89 ALDH1A1 (0.54) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL6276955 0.84 ALDH1A1 (0.50) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL6584152 0.83 L3MBTL1 (0.47) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL27953522 0.81 ALDH1A1 (0.46) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL852674 0.81 ALDH1A1 (0.46) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL5922952 0.80 ALDH1A1 (0.47) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL2321958 0.79
SCHEMBL2907286 0.79 ALDH1A1 (0.45) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL2907288 0.79 ALDH1A1 (0.45) ALDH1A1TRPA1GAAMGAMSI
SCHEMBL1405832 0.78 ALDH1A1 (0.54) ALDH1A1TRPA1GAAMGAMSI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250270215-A1 IMIDAZOLE DERIVATIVES AS ALK5 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2025-08-28 US disclosed
EP-4514802-A1 IMIDAZOLE DERIVATIVES AS ALK5 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2025-03-05 EP disclosed
CN-117343220-A Method for preparing brominated polystyrene by high-stability liquid bromine method 潍坊鑫洋化工有限公司 2024-01-05 CN disclosed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
US-11858946-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-01-02 US disclosed
WO-2023208986-A1 IMIDAZOLE DERIVATIVES AS ALK5 INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2023-11-02 WO disclosed
US-20220112203-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-04-14 US disclosed
US-10995097-B2 Small molecules active against gram-negative bacteria THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-05-04 US disclosed
US-20190135821-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2019-05-09 US disclosed
WO-2017156519-A1 SMALL-MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2017-09-14 WO disclosed
US-4316025-A STABVILIZERS FOR POLYMERS CHIMOSA CHIMICA ORGANICA S.P.A. (IT) 1982-02-16 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 (5 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-10995097-B2 Small molecules active against gram-negative bacteria PGLS, MRPL21, CLPP ALDH1A1 3613/4885TRPA1 3309/4885GAA 51/4885
US-20220112203-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA PGLS, MRPL21, CLPP ALDH1A1 3814/4885TRPA1 3455/4885GAA 75/4885
US-11858946-B2 Small molecules active against gram-negative bacteria PGLS, MRPL21, CLPP ALDH1A1 3814/4885TRPA1 3455/4885GAA 75/4885
US-20250270215-A1 IMIDAZOLE DERIVATIVES AS ALK5 INHIBITORS ALK, TGFBR1, TGFBR2 ALDH1A1 828/4885TRPA1 2712/4885GAA 778/4885
US-20190135821-A1 SMALL MOLECULES ACTIVE AGAINST GRAM-NEGATIVE BACTERIA PGLS, MRPL21, CLPP ALDH1A1 3613/4885TRPA1 3309/4885GAA 51/4885

“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.