SCHEMBL30720833

SCHEMBL30720833

CCOC(=O)C=NNc1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
CYP1A2 P05177 2/20 0.50
KDM4E B2RXH2 4/20 0.49
GAA P10253 3/20 0.49
TDP1 Q9NUW8 1/20 0.49
THRB P10828 1/20 0.48
ALOX12 P18054 1/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
CASP3 P42574 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
LMNA P02545 3/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.41

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
SCHEMBL30720836 0.88 MAPT (0.52) MAPTCYP1A2GAAALDH1A1KMT2A
SCHEMBL27649304 0.85 KMT2A (0.50) MAPTCYP1A2GAATDP1ALOX12
SCHEMBL30720837 0.85 KYAT1 (0.49) MAPTKDM4EGAATDP1ALDH1A1
SCHEMBL14059066 0.84 MAPT (0.52) MAPTCYP1A2KDM4EGAATDP1
SCHEMBL14269202 0.84 MAPT (0.52) MAPTCYP1A2KDM4EGAATDP1
SCHEMBL14059065 0.84 MAPT (0.52) MAPTCYP1A2KDM4EGAATDP1
SCHEMBL20133846 0.84 MPO (0.48) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL27676492 0.84 MPO (0.48) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL5448837 0.84 KYAT1 (0.50) MAPTCYP1A2KDM4EGAATDP1
SCHEMBL5448834 0.84 KYAT1 (0.50) MAPTCYP1A2KDM4EGAATDP1

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
EP-4555128-A1 ELECTROCHEMICAL SYNTHESIS OF PYRAZOLINES AND PYRAZOLES Bayer Aktiengesellschaft (DE) 2025-05-21 EP disclosed
WO-2024012791-A1 ELECTROCHEMICAL SYNTHESIS OF PYRAZOLINES AND PYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2024-01-18 WO disclosed