SCHEMBL8956322

SCHEMBL8956322

S=C(Nc1ccccc1)Nc1ccc(NC(=S)Nc2ccccc2)cc1

nearest known ligand 0.94

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.94
CYP3A4 P08684 1/20 0.94
TAS2R38 P59533 1/20 0.94
HSD17B10 Q99714 1/20 0.94
KMT2A Q03164 5/20 0.82
GAA P10253 5/20 0.82
MAOA P21397 2/20 0.82
MAOB P27338 2/20 0.82
LMNA P02545 1/20 0.82
MAPT P10636 4/20 0.78
MEN1 O00255 3/20 0.78
RAB9A P51151 2/20 0.78
NOX1 Q9Y5S8 3/20 0.76
NPC1 O15118 1/20 0.76
CYP1A2 P05177 2/20 0.69
CYP2C19 P33261 2/20 0.69
CYP2C9 P11712 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
PTPN7 P35236 1/20 0.64
KDM4E B2RXH2 2/20 0.64

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
SCHEMBL132620 0.97 ALDH1A1 (1.00) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL9470190 0.94 ALDH1A1 (0.94) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL9243020 0.93 ALDH1A1 (0.81) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL2235398 0.91 GAA (1.00) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
Thiourea SCHEMBL21055683 0.90 ALDH1A1 (0.85) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL5077463 0.89 KMT2A (1.00) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL5451731 0.89 ALDH1A1 (0.74) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL8956349 0.89 NOX1 (0.85) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL5137359 0.89 ALDH1A1 (1.00) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A
SCHEMBL5081276 0.89 NOX1 (0.85) ALDH1A1CYP3A4TAS2R38HSD17B10KMT2A

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-20250241890-A1 1,4-DIUREAS AND 1,4-DITHIOUREAS AND USES THEREOF PURDUE RESEARCH FOUNDATION 2025-07-31 US disclosed
CN-101129295-B There is the binary initiator system of good storage stability and especially suitable for acidic system HERAEUS KULZER GMBH (DE) 2016-02-10 CN disclosed
US-5498502-A POLYCYCLIC QUINONE COMPOUNDS WITH PHTHALOCYANINE DYES FOR PRINTING NIPPON PAINT CO., LTD. (JP) 1996-03-12 US disclosed
EP-0666507-A2 Negative charging type printing photosensitive resin composition Nippon Paint Co., Ltd. (JP) 1995-08-09 EP disclosed
US-4461821-A Photoconductive compositions and electrophotographic photosensitive materials comprising an organic photoconductor and a thiourea compound FUJI PHOTO FILM CO., LTD. (JP) 1984-07-24 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-20250241890-A1 1,4-DIUREAS AND 1,4-DITHIOUREAS AND USES THEREOF SNCA, PARK7, SYNCRIP ALDH1A1 723/4885CYP3A4 4137/4885TAS2R38 2802/4885

“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.