SCHEMBL20320352

SCHEMBL20320352

Cc1cc(C2(Cl)CC2)on1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CHRNB2 P17787 3/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNA7 P36544 1/20 0.32
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
TSHR P16473 1/20 0.31
CHRNA5 P30532 1/20 0.30

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
SCHEMBL9974040 0.78 HCAR2 (0.38) HCAR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20320350 0.72 POLB (0.34) HCAR2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL31595750 0.71 HCAR2 (0.36) HCAR2ALDH1A1SMN1; SMN2
SCHEMBL20320628 0.71 HCAR2 (0.32) HCAR2ALDH1A1
SCHEMBL15321857 0.70 HCAR2 (0.40) HCAR2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL15321889 0.69 HCAR2 (0.47) HCAR2MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7000790 0.68 CHRNB2 (0.37) MEN1KMT2ACHRNB2CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL7000062 0.67 CHRNB2 (0.36) MEN1KMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL4973106 0.67 CHRNB2 (0.33) HCAR2CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL20320549 0.67 SLC6A2 (0.40) KMT2AALDH1A1SMN1; SMN2KDM4ETSHR

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-20200390100-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES BAYER AG (DE) 2020-12-17 US disclosed
WO-2018114596-A1 SUBSTITUTED HETEROARYL PYRROLONES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-06-28 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 (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-20200390100-A1 SUBSTITUTED N-HETEROCYCLYL- AND N-HETEROARYL-TETRAHYDROPYRIMIDINONES AND THE SALTS THEREOF, AND THE USE OF SAME AS HERBICIDAL ACTIVE SUBSTANCES DDT, NOTUM, AGPS HCAR2 675/4885MEN1 3916/4885KMT2A 2086/4885

“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.