SCHEMBL9958035

SCHEMBL9958035

O=C(O)Nc1cc(C2(C(F)(F)F)CCC2)on1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.40
KIT P10721 5/20 0.39
BRAF P15056 2/20 0.39
KDR P35968 4/20 0.38
NEK7 Q8TDX7 2/20 0.38
TSHR P16473 1/20 0.35
KCNH2 Q12809 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9958245 0.94 FLT3 (0.43) FLT3KITBRAFKDRNEK7
SCHEMBL25793273 0.87 KIT (0.41) FLT3KITBRAFKDRNEK7
SCHEMBL23966921 0.81 FAAH (0.47) FLT3KITBRAFKDR
SCHEMBL18424542 0.81 KIT (0.44) FLT3KITBRAFKDRNEK7
SCHEMBL27217824 0.79 SMN1; SMN2 (0.42) TSHRSMN1; SMN2MEN1KMT2A
SCHEMBL1012949 0.76 BRAF (0.47) FLT3KITBRAFKDR
SCHEMBL27217912 0.75 SMN1; SMN2 (0.44) KDRTSHRSMN1; SMN2MEN1KMT2A
SCHEMBL24072584 0.75 CHRNB2 (0.31)
SCHEMBL16536880 0.74 KIT (0.56) FLT3KITKDRNEK7
SCHEMBL1254926 0.73 NEK7 (0.45) KITBRAFKDRNEK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4146348-B1 INHIBITORS OF NEK7 KINASE HALIA THERAPEUTICS INC (US) 2024-07-03 EP disclosed
US-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 US disclosed
US-20230416259-A1 INHIBITORS OF NEK7 KINASE HALIA THERAPEUTICS INC (US) 2023-12-28 US disclosed
US-11713321-B2 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2023-08-01 US disclosed
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME Halia Therapeutics, Inc. 2023-07-06 US disclosed
EP-4146348-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2023-03-15 EP disclosed
WO-2021242505-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. (US) 2021-12-02 WO disclosed
US-20210355130-A1 INHIBITORS OF NEK7 KINASE Halia Therapeutics, Inc. 2021-11-18 US disclosed
US-11161852-B1 Inhibitors of NEK7 kinase Halia Therapeutics, Inc. (US) 2021-11-02 US disclosed
US-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2013-02-07 US disclosed
EP-2467137-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2012-06-27 EP 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 (7 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-20210355130-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 FLT3 831/4885KIT 1657/4885BRAF 578/4885
US-11713321-B2 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 FLT3 831/4885KIT 1657/4885BRAF 578/4885
US-20230210853-A1 TARGETED NEK7 INHIBITION FOR MODULATION OF THE NLRP3 INFLAMMASOME NEK7, NLRP3, NOD1 FLT3 3082/4885KIT 4277/4885BRAF 1615/4885
US-11161852-B1 Inhibitors of NEK7 kinase NEK7, NEK1, NEK5 FLT3 831/4885KIT 1657/4885BRAF 578/4885
US-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 FLT3 3178/4885KIT 4204/4885BRAF 2323/4885
US-20130035326-A1 BIARYL COMPOUNDS AND METHODS OF USE THEREOF FLT3, CSF3R, CSF1R FLT3 1/4885KIT 4/4885BRAF 75/4885
US-20230416259-A1 INHIBITORS OF NEK7 KINASE NEK7, NEK1, NEK5 FLT3 831/4885KIT 1657/4885BRAF 578/4885

“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.