SCHEMBL24988730

SCHEMBL24988730

C=C(c1cc(C)nn1C)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.33
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
HTT P42858 1/20 0.31
CACNA1H O95180 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL24988223 0.87 LMNA (0.42) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL20745023 0.80 KDM4E (0.42) KDM4EGRNSORT1
SCHEMBL11982018 0.76 SMN1; SMN2 (0.39) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL13982847 0.76 LMNA (0.40) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL27637077 0.70 SMN1; SMN2 (0.48) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL334463 0.68 SMN1; SMN2 (0.47) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL286931 0.68 KDM4E (0.58) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL19818707 0.68 KDM4E (0.44) LMNASMN1; SMN2GAAKDM4EGRN
SCHEMBL20763628 0.68 KDM4E (0.45) KDM4EGRNSORT1
SCHEMBL24533846 0.67 JAK2 (0.52) LMNASMN1; SMN2GAACACNA1H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3668866-B1 PESTICIDAL AND PARASITICIDAL PYRAZOLE-ISOXAZOLINE COMPOUNDS BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2023-01-18 EP disclosed