SCHEMBL91375

SCHEMBL91375

C=C(C)c1ocnc1/C=c1\[nH]c(=O)/c(=C/c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ UBE2N P61088 1/20 0.41
▸ HTR6 P50406 10/20 0.41
▸ PLK1 P53350 1/20 0.39
▸ DRD2 P14416 2/20 0.38
▸ HTR2A P28223 2/20 0.38
▸ HTR7 P34969 2/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ AKR1C3 P42330 1/20 0.38
▸ AKR1C1 Q04828 1/20 0.38
▸ CA9 Q16790 2/20 0.37
▸ CA2 P00918 1/20 0.37
▸ TNFSF11 O14788 3/20 0.37
▸ TNF P01375 2/20 0.37
▸ CA12 O43570 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
SCHEMBL79214 0.86 KDM4E (0.41) LMNASMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL12727724 0.76 TUBB4A (0.37) SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL12727727 0.75 CYP1A2 (0.52) SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL91374 0.70 MEN1 (0.36) MEN1KMT2A
SCHEMBL12727762 0.67 CYP1A2 (0.37) LMNAMEN1KMT2AKDM4E
SCHEMBL14094861 0.67 CYP1A2 (0.40) LMNASMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL8582890 0.66 KDM4E (0.65) LMNASMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL12727719 0.65 POLB (0.35) LMNAMEN1KMT2AKDM4E
SCHEMBL12727822 0.65 TUBB4A (0.32) KDM4E
SCHEMBL15577151 0.65 LMNA (0.73) LMNASMN1; SMN2MEN1KMT2AHTR6

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
US-8129527-B2 cancer and non-cancer diseases associated with vascular proliferation; mitoxantrone resistant, taxol resistant cancers NEREUS PHARMACUTICALS, INC. (US) 2012-03-06 — — US disclosed
US-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE BEYONDSPRING PHARMACEUTICALS, INC. 2008-09-11 — — 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-20080221122-A1 ANALOGS OF DEHYDROPHENYLAHISTINS AND THEIR THEAPEUTIC USE HPGDS, DHPS, HCCS LMNA 2491/4885SMN1; SMN2 4383/4885MEN1 2127/4885

“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.

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