SCHEMBL18558139

SCHEMBL18558139

CCn1c(CNC(=O)c2ccc3c(c2)OCO3)nnc1SCC(=O)Nc1cc(C)ccc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 1.00
▸ MEN1 O00255 1/20 0.71
▸ KMT2A Q03164 1/20 0.71
▸ THRB P10828 1/20 0.66
▸ TDP1 Q9NUW8 1/20 0.61
▸ SMN1; SMN2 Q16637 5/20 0.60
▸ MAPT P10636 3/20 0.59
▸ TSHR P16473 4/20 0.56
▸ TP53 P04637 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ PTGES O14684 1/20 0.54
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ NPC1 O15118 1/20 0.51
▸ HTT P42858 1/20 0.51

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
SCHEMBL20682650 0.88 LMNA (0.78) LMNAMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL18559154 0.76 SMN1; SMN2 (0.85) LMNATHRBSMN1; SMN2MAPTTSHR
SCHEMBL18559345 0.75 SMN1; SMN2 (1.00) LMNATHRBSMN1; SMN2MAPTTP53
SCHEMBL15986500 0.74 MAPT (1.00) LMNAMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL15986548 0.73 SMN1; SMN2 (1.00) LMNAMEN1KMT2ATDP1SMN1; SMN2
SCHEMBL14970814 0.73 SMN1; SMN2 (0.71) LMNAMEN1KMT2ATHRBTDP1
SCHEMBL18559353 0.73 SMN1; SMN2 (1.00) MEN1KMT2ATHRBSMN1; SMN2MAPT
SCHEMBL14970841 0.71 THRB (0.68) LMNAMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL12216357 0.71 MAPK1 (0.77) LMNAMEN1KMT2ATHRBSMN1; SMN2
SCHEMBL14970840 0.70 TP53 (0.71) THRBSMN1; SMN2MAPTTSHRTP53

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
US-20230136150-A1 Compositions for Inhibition of Insect Sensing UNIV VANDERBILT (US) 2023-05-04 — — US disclosed
US-20210219551-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2021-07-22 — — US disclosed
US-10813355-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2020-10-27 — — US disclosed
US-20190075798-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2019-03-14 — — US disclosed
US-9578881-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2017-02-28 — — 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 (4 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-20230136150-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 LMNA 4714/4885MEN1 1675/4885KMT2A 4200/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 LMNA 4708/4885MEN1 1871/4885KMT2A 4243/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 LMNA 4714/4885MEN1 1675/4885KMT2A 4200/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 LMNA 4708/4885MEN1 1871/4885KMT2A 4243/4885

“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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