SCHEMBL7203385

SCHEMBL7203385

CC(C(=O)c1ccc(F)cc1)C(=O)c1cccs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.46
HPGD P15428 4/20 0.46
CYP2C9 P11712 3/20 0.46
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
KDM4E B2RXH2 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CES2 O00748 2/20 0.45
CES1 P23141 2/20 0.45
KEAP1 Q14145 1/20 0.45
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL29588329 0.85 HPGDS (0.58) MEN1KMT2AHPGDCYP2C9ALDH1A1
SCHEMBL1937375 0.85 RAB9A (0.58) MEN1KMT2AHPGDCYP2C9ALDH1A1
SCHEMBL7204235 0.84 RAB9A (0.55) MEN1KMT2AGAAHPGDCYP2C9
SCHEMBL28043394 0.78 NPC1 (0.53) MEN1KMT2AHPGDLMNARAB9A
SCHEMBL2074541 0.76 HPGDS (0.69) MEN1KMT2AGAAHPGDCYP2C9
SCHEMBL3839189 0.76 DAO (0.55) MEN1KMT2AHPGDCYP2C9ALDH1A1
SCHEMBL28843649 0.76 RAB9A (0.49) MEN1KMT2AGAAHPGDCYP2C9
SCHEMBL11252454 0.75 RAB9A (0.51) MEN1KMT2AHPGDCYP2C9ALDH1A1
SCHEMBL7163607 0.75 ALDH1A1 (0.51) MEN1KMT2AHPGDCYP2C9ALDH1A1
SCHEMBL11506364 0.74 CES2 (0.60) MEN1KMT2AGAAHPGDCYP2C9

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 MEN1 4820/4885KMT2A 3922/4885GAA 4416/4885

“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.