SCHEMBL20090863

SCHEMBL20090863

CCn1c(C(F)(F)F)cc2nc(-c3sc(C)cc3S(=O)(=O)CC)n(C)c2c1=O

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 9/20 0.32
▸ ADORA2A P29274 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PDE7A Q13946 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
SCHEMBL20090940 0.91 DDR1 (0.32) DDR1
SCHEMBL18171966 0.90 DDR1 (0.32) DDR1
SCHEMBL20086331 0.86 RAD51 (0.35) DDR1ADORA2A
SCHEMBL18181489 0.86 DDR1 (0.31) DDR1
SCHEMBL18181488 0.84 DDR1 (0.35) DDR1
SCHEMBL18181495 0.84 PTGS2 (0.34) DDR1ADORA2A
SCHEMBL20090883 0.82 ADORA2A (0.31) DDR1ADORA2ASMN1; SMN2PDE7A
SCHEMBL18171978 0.80 DDR1 (0.32) DDR1
SCHEMBL18073405 0.80 DDR1 (0.36) DDR1ADORA2ALMNAHTTSMN1; SMN2
SCHEMBL17494849 0.79 DDR1 (0.36) DDR1ADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180110226-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE MEMBERED RING HETEROCYLES SYNGENTA PARTICIPATIONS AG (CH) 2018-04-26 — — 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-20180110226-A1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR SUBSTITUTED FIVE MEMBERED RING HETEROCYLES SQOR, DDT, QSOX1 DDR1 4791/4885ADORA2A 4428/4885LMNA 4173/4885

“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.

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