SCHEMBL10193160

SCHEMBL10193160

CO/C(N)=N\C(c1ccc(Cl)cc1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 15/20 0.48
ACKR3 P25106 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
P4HTM Q9NXG6 1/20 0.42
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL10193271 0.94 BACE1 (0.46) BACE1ACKR3MEN1KMT2AALDH1A1
SCHEMBL10193227 0.90 SMN1; SMN2 (0.51) BACE1ACKR3ALDH1A1LMNASMN1; SMN2
SCHEMBL10193243 0.90 BACE1 (0.46) BACE1
SCHEMBL10193854 0.89 AURKA (0.52) BACE1
SCHEMBL10194093 0.85 BACE1 (0.42) BACE1ACKR3MEN1KMT2AP4HTM
SCHEMBL10193859 0.83 BACE1 (0.52) BACE1
SCHEMBL25916156 0.83 BACE1 (0.52) BACE1
SCHEMBL10193017 0.82 BACE1 (0.47) BACE1
SCHEMBL10193165 0.81 AURKA (0.48) BACE1ACKR3MEN1KMT2AALDH1A1
SCHEMBL10193841 0.81 AURKA (0.52) BACE1MEN1KMT2ASMN1; SMN2

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
EP-2415756-A1 ISOTHIOUREA DERIVATIVES OR ISOUREA DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY Shionogi&Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20120015961-A1 ISOTHIOUREA DERIVATIVES OR ISOUREA DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2012-01-19 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-20120015961-A1 ISOTHIOUREA DERIVATIVES OR ISOUREA DERIVATIVES HAVING BACE1 INHIBITORY ACTIVITY BACE1, BACE2, APP BACE1 1/4885ACKR3 3189/4885MEN1 3671/4885

“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.