SCHEMBL2835936

SCHEMBL2835936

CCOC(=O)c1csc(-c2cc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)ccc2Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
CYP19A1 P11511 1/20 0.40
RAB9A P51151 5/20 0.40
MAPT P10636 4/20 0.40
NPC1 O15118 4/20 0.40
POLB P06746 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
PKM P14618 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
ALDH1A1 P00352 2/20 0.38
GABRA2 P47869 2/20 0.38
GABRB2 P47870 2/20 0.38
CLK1 P49759 1/20 0.37
NOTUM Q6P988 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CDK5 Q00535 1/20 0.35

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
SCHEMBL2836314 0.90 MAOA (0.41) GAAMAPTNPSR1ALDH1A1NOTUM
SCHEMBL24960675 0.88 RAB9A (0.43) GAACYP19A1RAB9AMAPTNPC1
SCHEMBL1573450 0.85 ALDH1A1 (0.41) RAB9AMAPTNPC1NPSR1ALDH1A1
SCHEMBL24960690 0.85 GAA (0.46) GAACYP19A1RAB9AMAPTNPC1
SCHEMBL2838729 0.81 KDM4E (0.39) GAAALDH1A1LMNA
SCHEMBL6205890 0.81 EIF4E (0.30)
SCHEMBL6699195 0.80 CYP4F2 (0.44) RAB9AMAPTNPC1NPSR1PKM
SCHEMBL5732815 0.80 CNR1 (0.33) MAPTNPSR1ALDH1A1
SCHEMBL2836889 0.78 GABRA1 (0.37) GAAMAPTALDH1A1GABRA2
SCHEMBL2836064 0.78 MAPT (0.43) CYP19A1RAB9AMAPTNPC1RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 US claimed
US-20230015308-A1 SUBSTITUTED THIAZOLE AROMATIC RING-BASED COMPOUND AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-01-19 US disclosed
US-7754880-B2 Uracils having a herbicidal activity ISAGRO RICERCA S.R.L. (IT) 2010-07-13 US disclosed
US-20060025591-A1 New uracils having a herbicidal activity ISEM S.R.L. (IT) 2006-02-02 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 (2 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-20060025591-A1 New uracils having a herbicidal activity UNG, DDT, UMPS GAA 187/4885CYP19A1 1028/4885RAB9A 2151/4885
US-20230015308-A1 SUBSTITUTED THIAZOLE AROMATIC RING-BASED COMPOUND AND PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF WEE1, CBR3, GLRX3 GAA 2047/4885CYP19A1 848/4885RAB9A 4363/4885

“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.