SCHEMBL24129795

SCHEMBL24129795

COc1cc(NN=C(C#N)C#N)ccc1OCc1ncccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
TDP1 Q9NUW8 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
CYP3A4 P08684 3/20 0.41
MEN1 O00255 2/20 0.41
ALOX15 P16050 2/20 0.41
TSHR P16473 2/20 0.41
KMT2A Q03164 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CISD1 Q9NZ45 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 7/20 0.40
NPSR1 Q6W5P4 3/20 0.40
KDM4E B2RXH2 4/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
HIF1A Q16665 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL24130028 0.89 ALDH1A1 (0.48) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL24130151 0.87 MAPT (0.44) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL24130010 0.85 CTSV (0.54) MAPTSMN1; SMN2MEN1KMT2AHPGD
SCHEMBL24130098 0.84 TRPM5 (0.40) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL24130030 0.84 MRGPRX1 (0.57) KMT2AHSD17B10HPGDALDH1A1NPSR1
SCHEMBL24129957 0.83 KIT (0.45) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL922720 0.82 MAPT (0.50) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL24130037 0.81 MEN1 (0.48) MAPTTDP1SMN1; SMN2MEN1KMT2A
SCHEMBL24130099 0.81 HDAC1 (0.46) MAPTTDP1SMN1; SMN2CYP3A4MEN1
SCHEMBL24129819 0.81 ALDH1A1 (0.40) MAPTTDP1SMN1; SMN2CYP3A4MEN1

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-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
WO-2021256902-A1 CARBONOHYDRAZONOYL DICYANIDE COMPOUND INCLUDING AT LEAST TWO TYPES OF ARYL OR HETEROARYL LINKED BY NOVEL LINKER, AND USE THEREOF 한국과학기술연구원 2021-12-23 WO 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-20230278965-A1 NOVEL CARBONOHYDRAZONOYL DICYANIDE COMPOUNDS COMPRISING 2 OR MORE ARYL OR HETEROARYL CONNECTED VIA LINKER AND USE THEREOF AADAC, CBR3, MTCL3 MAPT 2830/4885TDP1 3945/4885SMN1; SMN2 4675/4885

“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.