SCHEMBL8901663

SCHEMBL8901663

Cc1ccccc1-c1c(O)c(CC(C)C)nn(CC(F)F)c1=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
AKR1B1 P15121 1/20 0.32
ELANE P08246 2/20 0.32
CTSG P08311 1/20 0.32
HEXA P06865 1/20 0.32
HEXB P07686 1/20 0.32
BRD4 O60885 1/20 0.32
GNRHR P30968 2/20 0.31
BCL2 P10415 1/20 0.31
MCL1 Q07820 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 2/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
USP2 O75604 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8902356 0.88 HEXA (0.38) KDM4EAKR1B1ELANEHEXAHEXB
SCHEMBL8901653 0.86 PDE5A (0.33) AKR1B1ELANEHEXAHEXBBRD4
SCHEMBL8902933 0.85 PTGS2 (0.35) KDM4EAKR1B1ELANECTSGHEXA
SCHEMBL8902897 0.85 ELANE (0.34) ELANEBRD4MEN1KMT2A
SCHEMBL8900862 0.84 ELANE (0.35) KDM4EELANEBRD4KMT2AALDH1A1
SCHEMBL8900923 0.84 KMT2A (0.42) AKR1B1MEN1KMT2AHPGDALDH1A1
SCHEMBL8901027 0.82 CASR (0.41) MEN1KMT2A
SCHEMBL8902294 0.82 ALDH1A1 (0.38) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL8902439 0.81 LMNA (0.39) AKR1B1MEN1KMT2AHPGDALDH1A1
SCHEMBL8902906 0.81 GNRHR (0.35) KDM4EGNRHRMEN1KMT2APOLB

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 KDM4E 684/4885AKR1B1 371/4885ELANE 3397/4885

“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.