SCHEMBL2885135

SCHEMBL2885135

O=S(=O)(Cc1cc[nH]n1)c1nccs1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SLC40A1 Q9NP59 1/20 0.33
▸ NAMPT P43490 2/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ CDK5 Q00535 1/20 0.30
▸ CDK5R1 Q15078 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3511229 0.72 CYP2C19 (0.40) PKMALDH1A1SLC40A1NAMPT
SCHEMBL20679918 0.71 NAMPT (0.46) ALDH1A1SLC40A1NAMPTNPC1SMN1; SMN2
SCHEMBL28291561 0.70 SLC40A1 (0.50) PKMALDH1A1SLC40A1NAMPTSMN1; SMN2
SCHEMBL5785411 0.69 LTA4H (0.38) PKMALDH1A1NPC1RAB9ACDK5
SCHEMBL8797268 0.69 FBP1 (0.38) PKMALDH1A1SLC40A1NAMPTSMN1; SMN2
SCHEMBL14636694 0.69 ALDH1A1 (0.53) PKMALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL25429553 0.68 CA2 (0.39) —
SCHEMBL27500441 0.68 — —
SCHEMBL3545877 0.68 — —
SCHEMBL20679889 0.67 CYP2A6 (0.41) ALDH1A1SLC40A1SMN1; SMN2

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-8754234-B2 Chiral 2-(benzylsulfinyl)thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2014-06-17 — — US disclosed
US-20100285958-A1 Chiral 2-(benzylsulfinyl)Thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-11-11 — — 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-20100285958-A1 Chiral 2-(benzylsulfinyl)Thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators STS, SULT2A1, SLTM PKM 382/4885ALDH1A1 933/4885SLC40A1 3951/4885

“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.

Send feedback