SCHEMBL19084106

SCHEMBL19084106

CCCC(CC)n1ccc(C)n1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
NPC1 O15118 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NOS1 P29475 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31

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
SCHEMBL10205365 0.88 LMNA (0.39) LMNATSHRKMT2AMAPTRAB9A
SCHEMBL22255172 0.79 LMNA (0.34) LMNAKMT2AMAPTRAB9ANPC1
SCHEMBL26382784 0.75 LMNA (0.31) LMNATSHRMAPTSMN1; SMN2
SCHEMBL1061777 0.73 LMNA (0.40) LMNAKMT2AMAPTRAB9ANPC1
SCHEMBL11342505 0.73 LMNA (0.40) LMNAKMT2AMAPTRAB9ANPC1
SCHEMBL11339934 0.71 LMNA (0.37) LMNAKMT2AMAPTRAB9ANPC1
SCHEMBL2462529 0.71 MAPT (0.40) LMNAKMT2AMAPTRAB9ANPC1
SCHEMBL19501170 0.70 TSHR (0.31) TSHR
SCHEMBL27498779 0.70 TSHR (0.34) TSHR
Ammonia Solution, Strong SCHEMBL29168174 0.67 LMNA (0.41) LMNAKMT2AMAPTRAB9ANPC1

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-20170188581-A1 INSECTICIDAL AND NEMATOCIDAL ACTIVE INGREDIENT COMBINATIONS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-07-06 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-20170188581-A1 INSECTICIDAL AND NEMATOCIDAL ACTIVE INGREDIENT COMBINATIONS ACHE, DDT, VIP LMNA 3608/4885TSHR 4386/4885KMT2A 3078/4885

“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.