SCHEMBL7200004

SCHEMBL7200004

Fc1cccc(F)c1C1CC(c2cccs2)=NN1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.40
CA2 P00918 1/20 0.40
MAPT P10636 11/20 0.38
KDM4E B2RXH2 9/20 0.38
MEN1 O00255 7/20 0.38
KMT2A Q03164 7/20 0.38
ALDH1A1 P00352 8/20 0.37
TDP1 Q9NUW8 6/20 0.37
L3MBTL1 Q9Y468 6/20 0.37
GLA P06280 5/20 0.37
GAA P10253 5/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
ATM Q13315 4/20 0.37
MAPK1 P28482 3/20 0.37
LMNA P02545 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PBRM1 Q86U86 1/20 0.36
HTT P42858 1/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 3/20 0.35

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
SCHEMBL7200415 0.89 MAPT (0.39) CA1CA2MAPTKDM4EMEN1
SCHEMBL7205494 0.84 CA1 (0.58) CA1CA2MAPTKDM4EMEN1
SCHEMBL7200903 0.84 PRKCZ (0.39) CA1CA2MAPTKDM4EMEN1
SCHEMBL7200914 0.81 MAPT (0.43) CA1CA2MAPTKDM4EMEN1
SCHEMBL7203648 0.81 MAPT (0.47) CA1CA2MAPTKDM4EMEN1
SCHEMBL7202014 0.80 CA1 (0.56) CA1CA2MAPTKDM4EMEN1
SCHEMBL7207755 0.80 MAPT (0.41) CA1MAPTKDM4EMEN1KMT2A
SCHEMBL7203468 0.77 MAPT (0.52) CA1CA2MAPTKDM4EMEN1
SCHEMBL7200597 0.77 CA1 (0.52) CA1CA2MAPTKDM4EMEN1
SCHEMBL7203641 0.76 MAPT (0.48) CA1CA2MAPTKDM4EMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6605730-B2 3-(2-Thienyl)-5-phenyl-1H-pyrazole compounds of given formula NIHON BAYER AGROCHEM K.K. (JP) 2003-08-12 US disclosed
US-20030028034-A1 Nematicidal pyrazoles WADA KATSUAKI (JP) 2003-02-06 US disclosed
US-6310049-B1 3-(2-THIENYL),5-(SUBSTITUTED PHENYL)-1H-PYRAZOLES AND 3-(SUBSTITUTED PHENYL),5-(2-THIENYL)-1H-PYRAZOLES OF GIVEN FORMULA; ANTHELMINTICS NIHON BAYER AGROCHEM K.K. (JP) 2001-10-30 US disclosed
EP-1104418-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2001-06-06 EP disclosed
WO-2000009500-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-24 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-20030028034-A1 Nematicidal pyrazoles CBR3, CBR1, CCR4 CA1 1995/4885CA2 322/4885MAPT 4683/4885

“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.