SCHEMBL13034201

SCHEMBL13034201

CC(C)(C)c1ccc(NCCN2CCOCC2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.58
ABL1 P00519 3/20 0.53
BCR P11274 3/20 0.53
TLR9 Q9NR96 1/20 0.49
EPHX2 P34913 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 4/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
CD274 Q9NZQ7 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL9491355 0.91 SIGMAR1 (0.63) SIGMAR1ABL1BCRL3MBTL1LMNA
SCHEMBL25040036 0.86 KDM4E (0.54) SIGMAR1EPHX2LMNAKMT2AMEN1
SCHEMBL13841388 0.83 TSHR (0.60) L3MBTL1LMNAKMT2AMEN1KDM4E
SCHEMBL8245365 0.81 KMT2A (0.65) SIGMAR1EPHX2LMNAKMT2AMEN1
SCHEMBL25039506 0.81 ICMT (0.42) SIGMAR1ABL1BCRLMNAKMT2A
SCHEMBL11916145 0.80 ABL1 (0.52) SIGMAR1ABL1BCREPHX2L3MBTL1
SCHEMBL15315541 0.80 RAB9A (0.47) SIGMAR1ABL1BCRL3MBTL1LMNA
SCHEMBL13547569 0.80 TRPC5 (0.49) SIGMAR1ABL1BCRLMNAKMT2A
SCHEMBL2054619 0.80 SMN1; SMN2 (0.71) EPHX2LMNAKMT2AMEN1CD274
SCHEMBL3222264 0.80 CD274 (0.55) ABL1BCRL3MBTL1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023016447-A1 FERROPTOSIS MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-02-16 WO disclosed
US-7842708-B2 Arylpropionamide, arylacrylamide, arylpropynamide, or arylmethylurea analogs as factor XIa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-11-30 US disclosed
US-20100022506-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-01-28 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-20100022506-A1 ARYLPROPIONAMIDE, ARYLACRYLAMIDE, ARYLPROPYNAMIDE, OR ARYLMETHYLUREA ANALOGS AS FACTOR XIA INHIBITORS TFPI, F11, F12 SIGMAR1 4411/4885ABL1 467/4885BCR 1739/4885

“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.