SCHEMBL595444

SCHEMBL595444

CCOC(=O)c1nc(Br)sc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
CYP1A2 P05177 2/20 0.49
GAA P10253 2/20 0.43
MAPT P10636 4/20 0.42
NPSR1 Q6W5P4 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TLR9 Q9NR96 1/20 0.42
TARBP2 Q15633 2/20 0.41
GLP1R P43220 1/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 2/20 0.40

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
SCHEMBL9861374 0.84 ALDH1A1 (0.50) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL10317272 0.84 ALDH1A1 (0.50) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL299269 0.82 GAA (0.56) ALDH1A1CYP1A2GAAMAPTNPC1
SCHEMBL8726638 0.82 ALDH1A1 (0.51) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL10350633 0.82 ALDH1A1 (0.45) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL595150 0.81 ALDH1A1 (0.69) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL16705221 0.81 ALDH1A1 (0.47) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL26281760 0.81 ALDH1A1 (0.47) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL1919483 0.81 ALDH1A1 (0.68) ALDH1A1CYP1A2GAAMAPTNPSR1
SCHEMBL16397410 0.80 NPSR1 (0.50) ALDH1A1MAPTNPSR1HSD17B10HPGD

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025030117-A1 FERROPTOSIS INDUCERS ARPEGGIO BIOSCIENCES, INC. (US) 2025-02-06 WO disclosed
WO-2024175925-A1 MC2R MODULATOR COMPOUNDS Omass Therapeutics Limited (GB) 2024-08-29 WO disclosed
CN-117777051-B Synthesis method of 2-bromo-5-chlorothiazole-4-carboxylate 山西永津集团有限公司 2024-07-02 CN disclosed
CN-117777051-A Synthesis method of 2-bromo-5-chlorothiazole-4-carboxylate 山西永津集团有限公司 2024-03-29 CN disclosed
US-20220289698-A1 INHIBITORS OF HUMAN ATGL Karl-Franzens-Universität Graz (AT) 2022-09-15 US disclosed
WO-2019040511-A1 DUAL INHIBITORS OF THE BCL-2 AND HDM2 FAMILIES THROUGH CO-MIMICRY OF THE BH3 AND P53-ALPHA-HELICES UNIVERSITY OF MARYLAND BATIMORE (US) 2019-02-28 WO disclosed
WO-2019040511-A1 DUAL INHIBITORS OF THE BCL-2 AND HDM2 FAMILIES THROUGH CO-MIMICRY OF THE BH3 AND P53-ALPHA-HELICES UNIVERSITY OF MARYLAND BATIMORE (US) 2019-02-28 WO disclosed
WO-2018177993-A1 PYRAZOLES FOR CONTROLLING ARTHROPODS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-10-04 WO disclosed
EP-3262035-A1 ALKYNYL ALCOHOLS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2018-01-03 EP disclosed
WO-2016135163-A1 ALKYNYL ALCOHOLS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2016-09-01 WO disclosed
US-20120053149-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-03-01 US disclosed
US-20120053149-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-03-01 US disclosed
US-20120053149-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2012-03-01 US disclosed
EP-2421859-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-02-29 EP disclosed
US-8114893-B2 Compounds and methods of use GENENTECH, INC. (US) 2012-02-14 US disclosed
US-8114893-B2 Compounds and methods of use GENENTECH, INC. (US) 2012-02-14 US disclosed
WO-2010122504-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-10-28 WO disclosed
US-20100190782-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-07-29 US disclosed
US-20100190782-A1 COMPOUNDS AND METHODS OF USE ABBVIE INC. 2010-07-29 US disclosed
WO-2010080478-A1 COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2010-07-15 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 (3 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-20120053149-A1 THIAZOLE DERIVATIVES AND THEIR USE AS P2Y12 RECEPTOR ANTAGONISTS P2RY12, P2RY1, P2RY2 ALDH1A1 617/4885CYP1A2 1032/4885GAA 3166/4885
US-20220289698-A1 INHIBITORS OF HUMAN ATGL LIPC, LIPG, PNLIP ALDH1A1 2464/4885CYP1A2 3149/4885GAA 101/4885
US-20100190782-A1 COMPOUNDS AND METHODS OF USE BCL2A1, BCL2, BAX ALDH1A1 3814/4885CYP1A2 706/4885GAA 3546/4885

“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.