SCHEMBL30848670

SCHEMBL30848670

[2H]C([2H])([2H])Oc1ccccc1C(=O)NCC1(F)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
KMT2A Q03164 1/20 0.54
KCNA3 P22001 10/20 0.54
P2RX7 Q99572 2/20 0.52
HCN4 Q9Y3Q4 5/20 0.51
HCN1 O60741 4/20 0.51
TP53 P04637 2/20 0.51
HPGD P15428 2/20 0.47
GLA P06280 1/20 0.47

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
SCHEMBL30848473 0.91 MEN1 (0.64) MEN1ALDH1A1KMT2AKCNA3P2RX7
SCHEMBL30848437 0.77 P2RX7 (0.59) MEN1KMT2AP2RX7HCN1HPGD
SCHEMBL28448824 0.77 HPGD (0.50) MEN1ALDH1A1KMT2AKCNA3P2RX7
SCHEMBL31275290 0.77 MEN1 (0.37) MEN1ALDH1A1KMT2AKCNA3P2RX7
SCHEMBL30848511 0.74 MEN1 (0.60) MEN1ALDH1A1KMT2AKCNA3P2RX7
SCHEMBL31275179 0.73 MEN1 (0.48) MEN1ALDH1A1KMT2AKCNA3P2RX7
SCHEMBL30848447 0.70 LMNA (0.59) ALDH1A1KCNA3P2RX7TP53
SCHEMBL3455503 0.70 MEN1 (1.00) MEN1ALDH1A1KMT2AKCNA3
SCHEMBL31685209 0.70 KCNA3 (1.00) MEN1ALDH1A1KMT2AKCNA3
SCHEMBL1946359 0.70 KCNA3 (1.00) MEN1ALDH1A1KMT2AKCNA3

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
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN claimed
CN-118043327-A FGFR inhibitors and methods of use thereof 思康睿奇(上海)药业有限公司 2024-05-14 CN disclosed