SCHEMBL24416993

SCHEMBL24416993

CCCCC(O)c1ccc(F)cc1-c1nnnn1C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 14/20 0.35
ADAM17 P78536 1/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL29557058 1.00 CCR3 (0.35) CCR3ADAM17ALDH1A1
SCHEMBL24416935 0.96 ALDH1A1 (0.35) CCR3ADAM17ALDH1A1
SCHEMBL29557399 0.96 ALDH1A1 (0.35) CCR3ADAM17ALDH1A1
SCHEMBL29557232 0.94 CYP11B1 (0.36) CCR3ADAM17ALDH1A1
SCHEMBL24416928 0.94 CYP11B1 (0.36) CCR3ADAM17ALDH1A1
SCHEMBL24416865 0.85 SMN1; SMN2 (0.32) CCR3ALDH1A1
SCHEMBL29557260 0.85 HIF1A (0.45) CCR3ALDH1A1
SCHEMBL24417223 0.85 SMN1; SMN2 (0.40) ALDH1A1
SCHEMBL24416864 0.85 HIF1A (0.45) CCR3ALDH1A1
SCHEMBL29557274 0.85 SMN1; SMN2 (0.40) ALDH1A1

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
CN-114436985-A Tetrazole derivative, preparation method thereof, pharmaceutical composition containing tetrazole derivative and application of pharmaceutical composition 浙江大学 2022-05-06 CN claimed
CN-112457265-A Tetrazole derivative, preparation method thereof, pharmaceutical composition containing tetrazole derivative and application of pharmaceutical composition 浙江大学 2021-03-09 CN claimed
WO-2022095965-A1 TETRAZOLE DERIVATIVE, PREPARATION FOR TETRAZOLE DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING TETRAZOLE DERIVATIVE, AND APPLICATION OF TETRAZOLE DERIVATIVE 浙江大学 2022-05-12 WO disclosed
CN-114436985-A Tetrazole derivative, preparation method thereof, pharmaceutical composition containing tetrazole derivative and application of pharmaceutical composition 浙江大学 2022-05-06 CN disclosed
CN-112457265-A Tetrazole derivative, preparation method thereof, pharmaceutical composition containing tetrazole derivative and application of pharmaceutical composition 浙江大学 2021-03-09 CN disclosed