SCHEMBL18795129

SCHEMBL18795129

O=Cc1nc2cc(Cl)ccc2cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41
NR4A2 P43354 1/20 0.40
POLB P06746 1/20 0.38
PDGFRB P09619 1/20 0.38
PDGFRA P16234 1/20 0.38
ERN1 O75460 1/20 0.37
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
S1PR4 O95977 1/20 0.36
HSD17B10 Q99714 1/20 0.35
JAK2 O60674 1/20 0.35
GAA P10253 1/20 0.35
VDR P11473 1/20 0.35
F7 P08709 1/20 0.35
F3 P13726 1/20 0.35

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
SCHEMBL18819816 0.87 TDP1 (0.52) TDP1ALDH1A1RXFP1NR4A2ERN1
SCHEMBL6965074 0.81 ALDH1A1 (0.46) TDP1ALDH1A1RXFP1HTR3AGAA
SCHEMBL4194871 0.76 KMT2A (0.45) TDP1ALDH1A1RXFP1POLBHSD17B10
SCHEMBL4488260 0.76 ALDH1A1 (0.70) TDP1ALDH1A1RXFP1NR4A2POLB
SCHEMBL31345649 0.76 ALDH1A1 (0.70) TDP1ALDH1A1RXFP1NR4A2POLB
SCHEMBL3748357 0.74 CCR1 (0.48) TDP1ALDH1A1NR4A2POLBHTR3E
SCHEMBL7608692 0.74 NR4A2 (0.52) ALDH1A1RXFP1NR4A2POLBPDGFRB
SCHEMBL28208080 0.74 NR4A2 (0.44) ALDH1A1RXFP1NR4A2POLBPDGFRB
SCHEMBL18795087 0.72 KMT2A (0.49) ALDH1A1RXFP1NR4A2POLBPDGFRB
SCHEMBL28277834 0.72 POLB (0.45) TDP1ALDH1A1NR4A2POLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108430986-B Fused bicyclic heterocyclic derivatives as pest control agents 拜耳作物科学股份公司 2021-08-31 CN disclosed
US-10550116-B2 Fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-04 US disclosed
US-10550116-B2 Fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-04 US disclosed
US-20180305353-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-10-25 US disclosed
EP-3368521-A1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2018-09-05 EP disclosed
CN-108430986-A fused bicyclic heterocyclic derivatives as pest control agents 拜耳作物科学股份公司 2018-08-21 CN disclosed
WO-2017072039-A1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-05-04 WO disclosed
WO-2017072039-A1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-05-04 WO 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 (2 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-20180305353-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, BCHE, ACHE TDP1 2328/4885ALDH1A1 468/4885RXFP1 1735/4885
US-10550116-B2 Fused bicyclic heterocycle derivatives as pesticides DDT, BCHE, ACHE TDP1 2328/4885ALDH1A1 468/4885RXFP1 1735/4885

“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.