SCHEMBL19783081

SCHEMBL19783081

Cc1c(F)c(OCCO)cc2sc(Br)nc12

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 3/20 0.32
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PI4KA P42356 1/20 0.31
PIK3CG P48736 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
LOX P28300 1/20 0.31
AOC3 Q16853 1/20 0.31
IKBKB O14920 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
SCHEMBL19783073 0.87 KMT2A (0.33) THRBKMT2APIK3CDPIK3CAPIK3CB
SCHEMBL19783123 0.84 S1PR4 (0.32) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL19783026 0.81 PDE10A (0.32) THRBKMT2APIK3CDPIK3CAPIK3CB
SCHEMBL19782756 0.80 MAPT (0.38) KMT2A
SCHEMBL19782757 0.80 LMNA (0.39) KMT2A
SCHEMBL19783430 0.74 ALDH1A1 (0.38) KMT2A
SCHEMBL19782975 0.73 PIK3CD (0.38) PIK3CDPIK3CAPIK3CBPI4KAPIK3CG
SCHEMBL19783016 0.73 ALDH1A1 (0.41) KMT2A
SCHEMBL19783063 0.73 NSD1 (0.37) KMT2A
SCHEMBL23463047 0.73 ALDH1A1 (0.44) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2021-06-03 US disclosed
US-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BISTOL MYERS SQUIBB COMPANY (US) 2019-09-26 US disclosed
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO 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 (2 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-20190292176-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, PF4 MKNK2 3420/4885THRB 845/4885KMT2A 2420/4885
US-20210163465-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS F2, F2RL3, F12 MKNK2 3621/4885THRB 612/4885KMT2A 2390/4885

“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.