Thiourea

Thiourea

SCHEMBL3629265

CC(C)c1ccc(OO)cc1.NC(N)=S

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.55
ALDH1A1 P00352 2/20 0.41
PRSS1 P07477 1/20 0.41
ACR P10323 1/20 0.41
MAPT P10636 1/20 0.40
ICAM1 P05362 1/20 0.40
SELE P16581 1/20 0.40
MEN1 O00255 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
IDO1 P14902 2/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
GRIN2D O15399 3/20 0.38
GRIN3B O60391 3/20 0.38
GRIN1 Q05586 3/20 0.38
GRIN2A Q12879 3/20 0.38
GRIN2B Q13224 3/20 0.38

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
SCHEMBL16628 0.89 RAB9A (0.46) HTTALDH1A1MAPTMEN1RAB9A
SCHEMBL18614728 0.89 RAB9A (0.46) HTTALDH1A1MAPTMEN1RAB9A
Methyl Alcohol SCHEMBL7601547 0.87 RAB9A (0.44) HTTALDH1A1MAPTMEN1RAB9A
Isopropylbenzene SCHEMBL4795495 0.81 MEN1 (0.46) MAPTMEN1RAB9AKMT2A
Acetone SCHEMBL11207944 0.81 RAB9A (0.49) ALDH1A1PRSS1ACRMAPTMEN1
Bicarbonate SCHEMBL11150406 0.81 RAB9A (0.49) MAPTMEN1RAB9AKMT2ACA12
Formaldehyde SCHEMBL8074512 0.81 RAB9A (0.44) HTTALDH1A1PRSS1ACRMAPT
Tert-Butyl Hydroperoxide SCHEMBL4657003 0.79 KMT2A (0.40) HTTALDH1A1MEN1RAB9AKMT2A
SCHEMBL8373970 0.78 RAB9A (0.39) HTTALDH1A1MAPTMEN1RAB9A
Benzoquinone SCHEMBL5141654 0.78 TYR (0.44) ALDH1A1PRSS1ACRMAPTICAM1

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
EP-2142163-B1 SELF-ADHESIVE DENTAL CEMENT DENTSPLY INT INC (US) 2015-11-04 EP disclosed
US-8198343-B2 Self-adhesive dental cement DENTSPLY INTERNATIONAL INC. (US) 2012-06-12 US disclosed
EP-2142163-A2 SELF-ADHESIVE DENTAL CEMENT Dentsply International Inc. (US) 2010-01-13 EP disclosed
US-20090048364-A1 Self-adhesive dental cement LIU HUAIBING 2009-02-19 US disclosed
WO-2008134024-A2 SELF-ADHESIVE DENTAL CEMENT DENTSPLY INTERNATIONAL INC. (US) 2008-11-06 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-20090048364-A1 Self-adhesive dental cement TBCA, HSPA4, HSPA4L HTT 191/4885ALDH1A1 632/4885PRSS1 3472/4885

“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.