SCHEMBL3759812

SCHEMBL3759812

[CH2]n1ccc(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
HSP90AA1 P07900 2/20 0.44
HSP90AB1 P08238 2/20 0.44
HSD11B1 P28845 3/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EGLN2 Q96KS0 1/20 0.41
AHR P35869 1/20 0.40
ALPL P05186 1/20 0.40
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
AR P10275 1/20 0.38

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
SCHEMBL3447441 0.80 HSD11B1 (0.53) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL3846649 0.70 HSD11B1 (0.41) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL29624840 0.68 AHR (0.64) HSP90AA1HSP90AB1HSD11B1MAPTAHR
SCHEMBL464507 0.68 AHR (0.64) HSP90AA1HSP90AB1HSD11B1MAPTAHR
SCHEMBL12859407 0.67 HSD11B1 (0.46) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL14996550 0.67 HSD11B1 (0.54) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL2751070 0.66 HSD11B1 (0.49) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL4032763 0.66 HSD11B1 (0.49) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A
SCHEMBL1691818 0.65 LMNA (0.53) LMNAHSP90AA1HSP90AB1MAPTEGLN2
SCHEMBL2751743 0.64 HSP90AA1 (0.44) LMNAHSP90AA1HSP90AB1HSD11B1KMT2A

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-8426631-B2 Fungicidal compounds, method for the production thereof, and use thereof to combat damaging fungi, and agents comprising the same BASF SE (DE) 2013-04-23 US disclosed
US-20100304966-A1 Fungicidal Compounds, Method For the Production Thereof, And Use Thereof To Combat Damaging Fungi, And Agents Comprising The Same BASF SE (DE) 2010-12-02 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-20100304966-A1 Fungicidal Compounds, Method For the Production Thereof, And Use Thereof To Combat Damaging Fungi, And Agents Comprising The Same CYP51A1, ERG28, CAT LMNA 1502/4885HSP90AA1 1685/4885HSP90AB1 1305/4885

“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.