SCHEMBL17992075

SCHEMBL17992075

CN(C)CS(=O)(=O)N1CCC2(CC1)Nc1ccccc1N=C2NCc1cccc(Cl)c1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 1/20 0.35
▸ ATXN2 Q99700 1/20 0.35
▸ CCNT1 O60563 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ ACAT2 Q9BWD1 1/20 0.33
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ MAOB P27338 2/20 0.32
▸ HTR6 P50406 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ SLC6A9 P48067 1/20 0.32

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
SCHEMBL17992049 0.92 ENPP2 (0.37) ENPP2ATXN2CCNT1CDK9ACAT2
SCHEMBL17992073 0.89 CCNT1 (0.42) CCNT1CDK9ACAT2PIK3CAPIK3CB
SCHEMBL25664185 0.85 ACAT2 (0.36) ACAT2PIK3CAPIK3CBMAOBHTR6
SCHEMBL17757457 0.85 ACAT2 (0.33) CCNT1CDK9ACAT2CNR1CNR2
SCHEMBL17757746 0.84 HRH4 (0.42) CCNT1CDK9ACAT2MAOBHTR6
SCHEMBL17992047 0.83 BRD4 (0.42) ACAT2
SCHEMBL17758095 0.83 CCNT1 (0.33) CCNT1CDK9ACAT2CNR1
SCHEMBL17992046 0.83 BRD4 (0.41) CNR1CNR2
SCHEMBL17992057 0.83 CHRM2 (0.38) CNR1CNR2
SCHEMBL17757475 0.82 ACAT2 (0.43) ACAT2MAOBHTR6

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 ENPP2 347/4885ATXN2 4349/4885CCNT1 4420/4885

“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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