SCHEMBL3437074

SCHEMBL3437074

COC(=O)c1ccc(Cl)c(CN(C)OC)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 3/20 0.39
POLB P06746 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
ABL1 P00519 1/20 0.39
PTGS2 P35354 1/20 0.37
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36

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
SCHEMBL3437045 0.87 TSHR (0.39) TSHRALDH1A1LMNAKMT2AMAPT
SCHEMBL23044880 0.80 LMNA (0.39) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL3436908 0.78 ABL1 (0.42) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL9079083 0.78 ABL1 (0.42) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL8307454 0.77 ABL1 (0.41) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL18298886 0.77 ABL1 (0.41) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL17681680 0.77 AKR1B1 (0.49) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL3436992 0.77 SLC6A3 (0.33) SLC6A3
SCHEMBL8145311 0.76 ABL1 (0.41) TSHRALDH1A1LMNAMEN1KMT2A
SCHEMBL4239740 0.75 PTGS2 (0.39) TSHRALDH1A1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807703-B2 Herbicides; pesticides BAYER CROPSCIENCE AG (DE) 2010-10-05 US disclosed
US-7807703-B2 Herbicides; pesticides BAYER CROPSCIENCE AG (DE) 2010-10-05 US disclosed
US-7807703-B2 Herbicides; pesticides BAYER CROPSCIENCE AG (DE) 2010-10-05 US disclosed
US-20050153958-A1 SUBSTITUTED ARYL KETONES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2005-07-14 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-20050153958-A1 SUBSTITUTED ARYL KETONES CYP1A1, CBR3, DDT TSHR 269/4885ALDH1A1 93/4885LMNA 2604/4885

“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.