SCHEMBL21652287

SCHEMBL21652287

CC(C)(C)c1csc(-c2ccc(Cl)c(Br)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
NTMT1 Q9BV86 1/20 0.37
ABL1 P00519 1/20 0.36
EIF4E P06730 9/20 0.36
KDM4E B2RXH2 4/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CCR4 P51679 2/20 0.34
HTT P42858 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
SHMT1 P34896 1/20 0.33
SHMT2 P34897 1/20 0.33
LMNA P02545 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL19625377 0.86 CNR1 (0.48) CNR1CNR2ABL1EIF4EKDM4E
SCHEMBL21652244 0.86 CNR1 (0.45) CNR1CNR2NTMT1KDM4ENPC1
SCHEMBL21652242 0.82 CNR1 (0.46) CNR1CNR2NTMT1ABL1EIF4E
SCHEMBL23367862 0.80 CYP3A4 (0.44) EIF4EKDM4ENPC1RAB9AMEN1
SCHEMBL21652237 0.79 CNR1 (0.46) CNR1CNR2NTMT1ABL1EIF4E
SCHEMBL17124797 0.78 GFER (0.53) CNR1CNR2NTMT1KDM4ENPC1
SCHEMBL21652327 0.78 SMN1; SMN2 (0.51) CNR1CNR2NTMT1KDM4ENPC1
SCHEMBL21652283 0.76 CYP19A1 (0.48) CNR1CNR2ABL1KDM4ENPC1
SCHEMBL8215623 0.74 RAB9A (0.54) CNR1CNR2NTMT1KDM4ENPC1
SCHEMBL21652239 0.74 RAB9A (0.46) CNR1CNR2NTMT1EIF4EKDM4E

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
EP-3395795-B1 MALONONITRILE OXIME ETHER COMPOUND AND USE THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2023-07-19 EP disclosed
US-10544092-B2 Malononitrile oxime ether compound and use thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2020-01-28 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-10544092-B2 Malononitrile oxime ether compound and use thereof ME1, MAL2, ME3 CNR1 2295/4885CNR2 2550/4885NTMT1 496/4885

“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.