SCHEMBL3978092

SCHEMBL3978092

CCOC(=O)c1conc1-c1cccc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.55
JAK3 P52333 4/20 0.55
TRPM8 Q7Z2W7 1/20 0.50
CSNK1D P48730 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 2/20 0.45
HPGD P15428 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
TSHR P16473 2/20 0.44

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
SCHEMBL11395576 0.85 JAK2 (0.55) JAK2JAK3TRPM8SMN1; SMN2ALDH1A1
SCHEMBL11396911 0.84 MEN1 (0.53) JAK2JAK3SMN1; SMN2ALDH1A1MAPT
SCHEMBL1776614 0.84 KDM4E (0.51) TRPM8SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL11396935 0.84 ALDH1A1 (0.56) JAK2JAK3SMN1; SMN2TDP1ALDH1A1
SCHEMBL11400381 0.82 TLR8 (0.47) POLBTDP1ALDH1A1LMNAMAPT
SCHEMBL5772148 0.82 ALDH1A1 (0.53) JAK2JAK3SMN1; SMN2ALDH1A1LMNA
SCHEMBL11400231 0.81 MAPT (0.55) SMN1; SMN2TDP1ALDH1A1MAPTMEN1
SCHEMBL5773232 0.81 TEAD2 (0.46) JAK2JAK3SMN1; SMN2POLBALDH1A1
SCHEMBL5771314 0.81 TEAD2 (0.48) JAK2JAK3SMN1; SMN2POLBALDH1A1
SCHEMBL5769963 0.81 MEN1 (0.41) JAK2JAK3SMN1; SMN2POLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11339130-B1 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-05-24 US disclosed
US-10934261-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2021-03-02 US disclosed
US-10894776-B2 2021-01-19 US disclosed
WO-2018064119-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF BLADE THERAPEUTICS, INC. (US) 2018-04-05 WO disclosed
US-7538132-B2 Isoxazolo derivatives HOFFMAN-LA ROCHE INC. (US) 2009-05-26 US disclosed
US-20070066668-A1 Isoxazolo derivatives F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 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 (4 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-10934261-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 JAK2 4186/4885JAK3 4766/4885TRPM8 1301/4885
US-10894776-B2 CAPNS1, CAPN9, CAPN2 JAK2 3719/4885JAK3 4609/4885TRPM8 1267/4885
US-11339130-B1 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN9, CAPN1 JAK2 4186/4885JAK3 4766/4885TRPM8 1301/4885
US-20070066668-A1 Isoxazolo derivatives GABRA5, GABRA4, GABRA1 JAK2 2809/4885JAK3 3680/4885TRPM8 2488/4885

“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.