SCHEMBL10962960

SCHEMBL10962960

CN(c1ccccc1)c1cc(NCc2cccs2)c(C#N)cc1S(N)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 2/20 0.50
▸ PDE4D Q08499 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ PKM P14618 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ USP2 O75604 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ CLK4 Q9HAZ1 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 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
SCHEMBL10963109 0.86 CISD1 (0.68) CISD1PDE4DPDE3APKMPOLB
SCHEMBL10963452 0.86 CISD1 (0.47) CISD1KDM4ELMNAHSD17B10CLK4
SCHEMBL11231644 0.84 CISD1 (0.52) CISD1PDE4DPDE3AKDM4EPKM
SCHEMBL10962587 0.83 ALDH1A1 (0.50) CISD1KDM4EPKMLMNAHSD17B10
SCHEMBL11223169 0.81 CISD1 (0.46) CISD1PDE4DPDE3AKDM4EPKM
SCHEMBL2873972 0.79 CISD1 (0.69) CISD1PDE4DPDE3AKDM4EATM
SCHEMBL11075640 0.78 ALDH1A1 (0.33) CISD1KDM4ELMNAALDH1A1PTGS2
SCHEMBL11111306 0.77 PDE4D (0.44) CISD1PDE4DPDE3AKDM4EPKM
Sulfuric Acid SCHEMBL11159036 0.77 CISD1 (0.45) CISD1PDE4DPDE3AKDM4EPKM
SCHEMBL10962539 0.71 CISD1 (0.66) CISD1KDM4EMEN1KMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0056970-B1 ANTHRANILIC ACIDS SUBSTITUTED BY BASIC GROUPS, PROCESS FOR THEIR PREPARATION AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1985-03-27 — — EP disclosed
US-4478843-A 5-Phenyltetrazoles and their use as salidiuretics HOECHST AKTIENGESELLSCHAFT (DE) 1984-10-23 — — US disclosed
EP-0051816-B1 5-PHENYLTETRAZOLES SUBSTITUTED BY BASIC GROUPS, METHOD FOR THEIR PREPARATION AND THEIR USE AS DRUGS HOECHST AKTIENGESELLSCHAFT (DE) 1984-05-02 — — EP disclosed
US-4406895-A Base-substituted anthranilic acids, a process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1983-09-27 — — US disclosed
EP-0056970-A1 Anthranilic acids substituted by basic groups, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1982-08-04 — — EP disclosed
EP-0051816-A1 5-Phenyltetrazoles substituted by basic groups, method for their preparation and their use as drugs HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 — — EP disclosed
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