SCHEMBL16291343

SCHEMBL16291343

NC(=O)c1occc1-c1cc(Cl)ccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 8/20 0.44
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 3/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TP53 P04637 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.39
JAK2 O60674 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.37

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
Hydrochloric Acid SCHEMBL10434178 0.84 DPP4 (0.41) ALDH1A1KDM4EHPGDHSD17B10JAK2
SCHEMBL6632749 0.80 IKBKB (0.44) SLC9A1ALDH1A1HSD17B10RAB9A
SCHEMBL6632966 0.78 IKBKB (0.41) SLC9A1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6634881 0.76 NUDT1 (0.47) SLC9A1RAB9A
SCHEMBL4238940 0.73 KDM4E (0.52) ALDH1A1KDM4EHPGDTP53GLA
SCHEMBL848820 0.73
SCHEMBL5692656 0.71 SLC9A1 (0.38) SLC9A1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL29364307 0.70 TP53 (0.61) ALDH1A1HSD17B10TP53LMNA
SCHEMBL440944 0.70 TP53 (0.61) ALDH1A1HSD17B10TP53LMNA
SCHEMBL30219241 0.69 ALDH1A1 (0.65) ALDH1A1KDM4EHPGDTP53JAK2

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-10633369-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2020-04-28 US disclosed
US-20180201606-A1 METHOD OF INHIBITING DYRK1B 4 SC AG (DE) 2018-07-19 US disclosed
US-9951050-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2018-04-24 US disclosed
US-20140371251-A1 METHOD OF INHIBITING DYRK1B 4SC DISCOVERY GMBH (DE) 2014-12-18 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 (3 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-10633369-B2 Method of inhibiting DYRK1B SMO, GLI1, GRK2 SLC9A1 3943/4885ALDH1A1 3401/4885KDM4E 996/4885
US-20180201606-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 SLC9A1 3943/4885ALDH1A1 3401/4885KDM4E 996/4885
US-20140371251-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 SLC9A1 3943/4885ALDH1A1 3401/4885KDM4E 996/4885

“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.