SCHEMBL31291101

SCHEMBL31291101

CC(C)(C)NC[C@H](O)c1ccc(O)cn1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 5/20 0.55
LMNA P02545 3/20 0.55
ADRB2 P07550 4/20 0.50
CASP7 P55210 2/20 0.50
KMT2A Q03164 2/20 0.50
TSHR P16473 2/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
ADRB1 P08588 2/20 0.48
KDM4E B2RXH2 1/20 0.44
CASP1 P29466 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
BLM P54132 1/20 0.44
ESR1 P03372 3/20 0.44
ESR2 Q92731 3/20 0.44
CYP2D6 P10635 2/20 0.43
NFKB1 P19838 2/20 0.43
CYP1A2 P05177 1/20 0.42

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
SCHEMBL10841508 1.00 HIF1A (0.55) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL20819384 1.00 HIF1A (0.55) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL22481252 0.84 HIF1A (0.51) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL22481311 0.84 HIF1A (0.51) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL20819349 0.83 HIF1A (0.50) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL10361058 0.83 LMNA (0.50) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL20819364 0.83 ADRB2 (0.52) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL17273622 0.83 HIF1A (0.50) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL20819365 0.83 ADRB2 (0.52) HIF1ALMNAADRB2CASP7KMT2A
SCHEMBL20819357 0.83 HIF1A (0.50) HIF1ALMNAADRB2CASP7KMT2A

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-20240398770-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA ATROGI AB (SE) 2024-12-05 US claimed

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-20240398770-A1 HETEROARYL SUBSTITUTED BETA-HYDROXYETHYLAMINES FOR USE IN TREATING HYPERGLYCAEMIA SLC5A2, SLC5A1, GPR119 HIF1A 688/4885LMNA 2140/4885ADRB2 92/4885

“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.