SCHEMBL3736878

SCHEMBL3736878

O=C(O)[C@](F)(Cc1ccccc1)N(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.50
HIF1A Q16665 1/20 0.50
CES1 P23141 6/20 0.46
FDPS P14324 1/20 0.40
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CES2 O00748 1/20 0.39
AKR1B1 P15121 1/20 0.39
PTPN1 P18031 1/20 0.39
FAAH O00519 3/20 0.39
CHRM1 P11229 3/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
RIPK1 Q13546 1/20 0.38
CPA1 P15085 1/20 0.38
ARG1 P05089 1/20 0.37
ARG2 P78540 1/20 0.37

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
SCHEMBL29112713 1.00 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL30887346 1.00 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL28369074 0.85 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL7316714 0.85 SMN1; SMN2 (0.50) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL29510761 0.80 SMN1; SMN2 (0.46) SMN1; SMN2HIF1ACES1CYP2C19NPC1
SCHEMBL26127150 0.79 SMN1; SMN2 (0.44) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL8153532 0.75 SMN1; SMN2 (0.57) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL5235928 0.75 SMN1; SMN2 (0.57) SMN1; SMN2HIF1ACES1FDPSCYP2C19
SCHEMBL73702 0.75 FDPS (0.44) SMN1; SMN2HIF1ACES1FDPSPTPN1
SCHEMBL454800 0.74 SMN1; SMN2 (0.52) SMN1; SMN2HIF1ACES1FDPSCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250049409-A1 METHODS OF QUANTIFYING SKELETAL MUSCLE PERFUSION USING PET IMAGING RESEARCH INSTITUTE AT NATIONWIDE CHILDREN'S HOSPITAL 2025-02-13 US claimed
CN-119907695-A Novel small gastrin-derived cholecystokinin 2 receptor binding molecules for imaging and targeted radiotherapy 慕尼黑工业大学 2025-04-29 CN disclosed
US-20250049409-A1 METHODS OF QUANTIFYING SKELETAL MUSCLE PERFUSION USING PET IMAGING RESEARCH INSTITUTE AT NATIONWIDE CHILDREN'S HOSPITAL 2025-02-13 US disclosed
WO-2024253964-A2 A COMPACT 7 MEV TO 11 MEV CYCLOTRON FOR MEDICAL ISOTOPES PRODUCTION BEST ABT, INC. (US) 2024-12-12 WO disclosed
EP-2785445-A1 PRODUCTION OF 18F- LABELLED COMPOUNDS COMPRISING HYDROLYTIC DEPROTECTION STEP AND SOLID PHASE EXTRACTION GE Healthcare UK Limited (GB) 2014-10-08 EP disclosed
US-8722014-B2 1 H-[1, 2, 3] triazole substituted amino acids and uses thereof WASHINGTON UNIVERSITY (US) 2014-05-13 US disclosed
WO-2013079578-A1 PRODUCTION OF 18F- LABELLED COMPOUNDS COMPRISING HYDROLYTIC DEPROTECTION STEP AND SOLID PHASE EXTRACTION GE HEALTHCARE LIMITED (GB) 2013-06-06 WO disclosed
US-20100278732-A1 1H-[1, 2, 3] TRIAZOLE SUBSTITUTED AMINO ACIDS AND USES THEREOF WASHINGTON UNIVERSITY (US) 2010-11-04 US disclosed
EP-1797029-A1 METHOD OF DEPROTECTION GE Healthcare Limited (GB) 2007-06-20 EP disclosed
WO-2006037950-A1 METHOD OF DEPROTECTION GE HEALTHCARE LIMITED (GB) 2006-04-13 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 (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-20100278732-A1 1H-[1, 2, 3] TRIAZOLE SUBSTITUTED AMINO ACIDS AND USES THEREOF SLC7A1, SLC1A5, SLC1A3 SMN1; SMN2 4022/4885HIF1A 1456/4885CES1 1094/4885

“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.