SCHEMBL8900910

SCHEMBL8900910

CCCc1nn(Cc2ccccc2)c(=O)c(-c2ccccc2C)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
PDE4A P27815 4/20 0.41
PDE4B Q07343 4/20 0.41
PDE4C Q08493 4/20 0.41
PDE4D Q08499 4/20 0.41
KMT2A Q03164 3/20 0.40
CHRM1 P11229 1/20 0.40
AKR1B1 P15121 1/20 0.39
PDE5A O76074 2/20 0.38
PDE6D O43924 1/20 0.38
PDE6A P16499 1/20 0.38
PDE6G P18545 1/20 0.38
PDE6B P35913 1/20 0.38
PDE6C P51160 1/20 0.38
PDE6H Q13956 1/20 0.38
CREBBP Q92793 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
MEN1 O00255 1/20 0.37
HDAC1 Q13547 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
SCHEMBL8903058 0.92 ALDH1A1 (0.40) ALDH1A1KMT2AAKR1B1
SCHEMBL8900926 0.91 PDE4A (0.42) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL8902391 0.91 ALDH1A1 (0.46) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL8902466 0.90 CASR (0.42) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL11965012 0.88 RECQL (0.43) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL11965017 0.87 PTGS2 (0.38) ALDH1A1AKR1B1PDE5A
SCHEMBL8902474 0.87 GAA (0.41) ALDH1A1KMT2ACHRM1AKR1B1MEN1
SCHEMBL8900923 0.85 KMT2A (0.42) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL8901319 0.85 MAPT (0.41) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL8901048 0.84 POLB (0.47) ALDH1A1PDE4APDE4BPDE4CPDE4D

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-8188008-B2 Herbicidally and insecticidally active 4-phenyl-substituted pyridazinones BAYER CROPSCIENCE AG (DE) 2012-05-29 US disclosed
US-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES BAYER CROPSCIENCE AG (DE) 2010-07-08 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-20100173775-A1 HERBICIDALLY AND INSECTICIDALLY ACTIVE 4-PHENYL-SUBSTITUTED PYRIDAZINONES CYP4X1, PRDX4, PRDX1 ALDH1A1 1001/4885PDE4A 540/4885PDE4B 534/4885

“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.