SCHEMBL19629675

SCHEMBL19629675

CCc1nccc(OC)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HASPIN Q8TF76 1/20 0.37
DYRK2 Q92630 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
MAPK1 P28482 3/20 0.36
PDE10A Q9Y233 3/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
PDE3B Q13370 3/20 0.36
PDE3A Q14432 3/20 0.36
USP2 O75604 2/20 0.36
LMNA P02545 2/20 0.36
CYP3A4 P08684 2/20 0.36
HIF1A Q16665 2/20 0.36
PDE2A O00408 1/20 0.36
ABCC4 O15439 1/20 0.36
PDE5A O76074 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 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
SCHEMBL191462 0.85 HASPIN (0.37) HASPINDYRK2SMN1; SMN2MAPK1PDE10A
SCHEMBL8435367 0.85 SMN1; SMN2 (0.46) SMN1; SMN2MAPK1ALDH1A1PDE3BPDE3A
SCHEMBL191261 0.85 HASPIN (0.40) HASPINDYRK2SMN1; SMN2MAPK1PDE10A
Hydrochloric Acid SCHEMBL191647 0.83 ALDH1A1 (0.38) HASPINDYRK2SMN1; SMN2MAPK1PDE10A
SCHEMBL28189540 0.83 HASPIN (0.42) HASPINDYRK2SMN1; SMN2MAPK1PDE10A
SCHEMBL12819972 0.78 MAPT (0.39) SMN1; SMN2MAPK1PDE10AKDM4EALDH1A1
SCHEMBL11918960 0.78 RAB9A (0.42) SMN1; SMN2MAPK1PDE10AKDM4EALDH1A1
SCHEMBL31214455 0.78 SMN1; SMN2 (0.35) SMN1; SMN2MAPK1PDE10AKDM4EALDH1A1
SCHEMBL16921629 0.77 ALOX5 (0.41) SMN1; SMN2MAPK1PDE10AKDM4EALDH1A1
SCHEMBL19780195 0.77 MAPT (0.41) SMN1; SMN2MAPK1PDE10AKDM4EALDH1A1

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-20200331881-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH, INC. 2020-10-22 US disclosed
WO-2017197555-A1 FUSED PYRAZINE DERIVATIVES USEFUL AS SOLUBLE GUANYLATE CYCLASE STIMULATORS MERCK SHARP & DOHME CORP. (US) 2017-11-23 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-20200331881-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS DHODH, DLD, DPYD HASPIN 3612/4885DYRK2 3671/4885SMN1; SMN2 3587/4885

“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.