SCHEMBL3377994

SCHEMBL3377994

Cc1ccc(S(=O)(=O)Nc2ccc(N)cn2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
KDM4E B2RXH2 4/20 0.64
SMN1; SMN2 Q16637 2/20 0.55
LMNA P02545 5/20 0.55
CYP2C19 P33261 2/20 0.55
MAPT P10636 2/20 0.52
ADRA1A P35348 1/20 0.52
PDE4A P27815 1/20 0.51
AGO2 Q9UKV8 1/20 0.51
CYP2C9 P11712 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
GAA P10253 1/20 0.48
PIK3CB P42338 1/20 0.48

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
SCHEMBL31748788 0.87 ALDH1A1 (0.82) ALDH1A1KDM4ELMNAMAPTGAA
SCHEMBL3486122 0.87 ALDH1A1 (0.82) ALDH1A1KDM4ELMNAMAPTGAA
SCHEMBL30354951 0.85 LMNA (0.63) ALDH1A1KDM4ESMN1; SMN2LMNACYP2C19
SCHEMBL30354773 0.84 SMN1; SMN2 (0.55) ALDH1A1KDM4ESMN1; SMN2LMNACYP2C19
SCHEMBL30354961 0.84 POLB (0.67) ALDH1A1KDM4ESMN1; SMN2LMNACYP2C19
SCHEMBL29151336 0.84 POLB (0.67) ALDH1A1KDM4ESMN1; SMN2LMNACYP2C19
SCHEMBL2927789 0.81 ALDH1A1 (0.83) ALDH1A1KDM4ESMN1; SMN2LMNAMAPT
SCHEMBL1318958 0.81 KDM4E (0.64) ALDH1A1KDM4E
SCHEMBL5252456 0.81 ALDH1A1 (0.64) ALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL29882882 0.79 ALDH1A1 (0.61) ALDH1A1KDM4ESMN1; SMN2LMNACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230278965-A1 NOVEL CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS COMPRISING 2 OR MORE ARYL OR HETEROARYL CONNECTED VIA LINKER AND USE THEREOF KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2023-09-07 US disclosed
EP-4169916-A1 CARBONOHYDRAZONOYL DICYANIDE COMPOUND INCLUDING AT LEAST TWO TYPES OF ARYL OR HETEROARYL LINKED BY NOVEL LINKER, AND USE THEREOF Korea Institute of Science and Technology (KR) 2023-04-26 EP disclosed
CN-115955968-A Carbohydrazone acyldinitrile compounds comprising at least two aryl or heteroaryl groups connected by a novel linker and uses thereof 韩国科学技术研究院 2023-04-11 CN disclosed
US-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2010-06-24 US disclosed
EP-1844768-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-10-17 EP 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 (2 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-20230278965-A1 NOVEL CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS COMPRISING 2 OR MORE ARYL OR HETEROARYL CONNECTED VIA LINKER AND USE THEREOF AADAC, CBR3, MTCL3 ALDH1A1 1104/4885KDM4E 2383/4885SMN1; SMN2 4675/4885
US-20100160304-A1 AROMATIC SULFONE COMPOUND AS ALDOSTERONE RECEPTOR MODULATOR NR3C2, AGTR1, AGTR2 ALDH1A1 1053/4885KDM4E 1109/4885SMN1; SMN2 2964/4885

“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.