SCHEMBL24848624

SCHEMBL24848624

CC(C)n1cc(C#N)c(F)n1

nearest known ligand 0.31

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.31
ABL1 P00519 2/20 0.31
EGFR P00533 2/20 0.31
HCK P08631 2/20 0.31
SRC P12931 2/20 0.31
KDR P35968 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CB P42338 2/20 0.31
MTOR P42345 2/20 0.31
PIK3CG P48736 2/20 0.31
EPHB4 P54760 2/20 0.31
PRKDC P78527 2/20 0.31
JAK2 O60674 1/20 0.31
TYK2 P29597 1/20 0.31
KDM5A P29375 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL4361482 0.78 KDM5A (0.33) KDM5AADORA2AADORA1
SCHEMBL8233937 0.77 ADORA2A (0.37) PIK3CDABL1EGFRHCKSRC
SCHEMBL15723768 0.77 LRRK2 (0.36) KDM5A
SCHEMBL12873380 0.74
SCHEMBL25019042 0.71 ADORA2A (0.37) ADORA2AADORA1
SCHEMBL15703081 0.71 ADORA2A (0.31) ADORA2AADORA1
SCHEMBL25018708 0.69 ADORA2A (0.33) ADORA2AADORA1
SCHEMBL15808415 0.67 HTT (0.36) JAK2TYK2
SCHEMBL25019153 0.67 ACHE (0.32) ADORA2AADORA1
SCHEMBL19224382 0.65 ADORA2A (0.33) ADORA2AADORA1

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
US-20230002364-A1 BENZOTHIOPHENE DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2023-01-05 US 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 (1 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-20230002364-A1 BENZOTHIOPHENE DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF GPER1, GABRQ, GPR39 PIK3CD 2412/4885ABL1 3063/4885EGFR 2254/4885

“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.