SCHEMBL17992088

SCHEMBL17992088

C=C(O)c1cccc(CNC2=Nc3ccccc3NC23CCSCC3)c1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.33
▸ HIF1A Q16665 2/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.30

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
SCHEMBL17757380 0.90 HIF1A (0.43) LMNAHIF1AHDAC8HDAC6MRGPRX4
SCHEMBL17992105 0.90 KMT2A (0.33) HIF1AHDAC8HDAC6MRGPRX4
SCHEMBL17992084 0.89 ACAT2 (0.36) HIF1AHDAC8HDAC6MRGPRX4
SCHEMBL17992054 0.89 LMNA (0.34) LMNA
SCHEMBL17992112 0.88 HDAC8 (0.32) HIF1AHDAC8HDAC6MRGPRX4
SCHEMBL17757846 0.86 LMNA (0.39) LMNA
SCHEMBL17757381 0.86 HRH3 (0.34) LMNAHIF1A
SCHEMBL19523220 0.86 TDO2 (0.38) HDAC8HDAC6
SCHEMBL19523089 0.86 FYN (0.38) LMNAHIF1A
SCHEMBL17992052 0.85 LMNA (0.31) LMNA

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-9802956-B2 Spiroquinoxaline derivatives as inhibitors of non-apoptotic regulated cell-death HELMHOLTZ ZENTRUM MUNCHEN-DEUTSCHES FORSCHUNGSZENTRUM FUR GESUNDHEIT UND UMWELT (GMBH) (DE) 2017-10-31 — — US disclosed
US-20160222025-A1 SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH HELMHOLTZ ZENTRUM MUNCHEN (DE) 2016-08-04 — — 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-20160222025-A1 SPIROQUINOXALINE DERIVATIVES AS INHIBITORS OF NON-APOPTOTIC REGULATED CELL-DEATH AIFM2, BAD, AIFM1 LMNA 1655/4885HIF1A 1205/4885HDAC8 940/4885

“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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