SCHEMBL17813790

SCHEMBL17813790

C/C=N/N=C1\SCCCN1C

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ INMT O95050 1/20 0.42
▸ PABPC1 P11940 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CTDSP1 Q9GZU7 2/20 0.39
▸ APOBEC3A P31941 1/20 0.39
▸ APOBEC3G Q9HC16 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
SCHEMBL17813788 0.89 INMT (0.40) INMT
SCHEMBL18827179 0.74 — —
SCHEMBL17813785 0.64 GRM5 (0.46) INMTPABPC1TSHRCTDSP1APOBEC3A
SCHEMBL8539633 0.62 — —
SCHEMBL19882277 0.61 INMT (0.45) INMT
SCHEMBL13507408 0.60 — —
Bromide SCHEMBL11737132 0.60 — —
SCHEMBL12020975 0.60 — —
SCHEMBL20219885 0.60 — —
SCHEMBL11459994 0.59 INMT (0.46) INMTPABPC1TSHRCTDSP1APOBEC3A

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-9497970-B2 Pesticide compounds BASF SE (DE) 2016-11-22 — — US disclosed
US-20160157491-A1 Pesticide Compounds BASF SE (DE) 2016-06-09 — — 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-20160157491-A1 Pesticide Compounds C1R, C1S, CBR3 INMT 1391/4885PABPC1 3607/4885TSHR 229/4885

“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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