SCHEMBL21707979

SCHEMBL21707979

CCCOC(=O)c1cc(OCCC)ccc1[N+](=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.60
SMN1; SMN2 Q16637 4/20 0.51
RAB9A P51151 3/20 0.50
NPC1 O15118 2/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
LMNA P02545 5/20 0.49
ALDH1A1 P00352 4/20 0.49
GLA P06280 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
SIRT5 Q9NXA8 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
MAPK1 P28482 3/20 0.45
TDP1 Q9NUW8 2/20 0.44
RAF1 P04049 1/20 0.43
ESR1 P03372 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL2155062 0.86 MAPT (0.63) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL21707908 0.85 TSHR (0.48) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL2155094 0.85 MAPT (0.66) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL22749339 0.85 MAPT (0.52) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL21707917 0.84 MAPT (0.44) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL4255397 0.84 TDP1 (0.55) MAPTSMN1; SMN2RAB9ANPC1CYP1A2
SCHEMBL29204387 0.83 ALDH1A1 (0.51) MAPTSMN1; SMN2RAB9ALMNAALDH1A1
SCHEMBL21707869 0.83 MAPT (0.58) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL8991985 0.82 ALDH1A1 (0.50) MAPTSMN1; SMN2RAB9ALMNAALDH1A1
SCHEMBL8381526 0.82 L3MBTL1 (0.58) MAPTLMNAALDH1A1L3MBTL1SIRT5

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-20240360085-A1 Glucose Uptake Inhibitors KADMON CORPORATION, LLC (US) 2024-10-31 US disclosed
US-12030857-B2 Glucose uptake inhibitors KADMON CORPORATION, LLC (US) 2024-07-09 US disclosed
US-12030857-B2 Glucose uptake inhibitors KADMON CORPORATION, LLC (US) 2024-07-09 US disclosed
US-12030857-B2 Glucose uptake inhibitors KADMON CORPORATION, LLC (US) 2024-07-09 US disclosed
US-20220363648-A1 Glucose Uptake Inhibitors KADMON CORPORATION, LLC 2022-11-17 US disclosed
US-11071735-B2 Treatment of inflammatory conditions and autoimmune diseases with glucose uptake inhibitors KADMON CORPORATION, LLC (US) 2021-07-27 US disclosed
US-11071735-B2 Treatment of inflammatory conditions and autoimmune diseases with glucose uptake inhibitors KADMON CORPORATION, LLC (US) 2021-07-27 US disclosed
US-20200046702-A1 TREATMENT OF INFLAMMATORY CONDITIONS AND AUTOIMMUNE DISEASES WITH GLUCOSE UPTAKE INHIBITORS KADMON CORPORATION, LLC 2020-02-13 US disclosed
US-20200046702-A1 TREATMENT OF INFLAMMATORY CONDITIONS AND AUTOIMMUNE DISEASES WITH GLUCOSE UPTAKE INHIBITORS KADMON CORPORATION, LLC 2020-02-13 US disclosed
WO-2018201006-A1 TREATMENT OF INFLAMMATORY CONDITIONS AND AUTOIMMUNE DISEASES WITH GLUCOSE UPTAKE INHIBITORS KADMON CORPORATION, LLC (US) 2018-11-01 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 (5 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-12030857-B2 Glucose uptake inhibitors SLC2A1, SLC2A4, SLC2A2 MAPT 1835/4885SMN1; SMN2 3766/4885RAB9A 1581/4885
US-20220363648-A1 Glucose Uptake Inhibitors SLC2A1, SLC2A4, SLC2A2 MAPT 1835/4885SMN1; SMN2 3766/4885RAB9A 1581/4885
US-11071735-B2 Treatment of inflammatory conditions and autoimmune diseases with glucose uptake inhibitors SLC2A3, SLC2A4, SLC2A1 MAPT 1704/4885SMN1; SMN2 3512/4885RAB9A 1218/4885
US-20200046702-A1 TREATMENT OF INFLAMMATORY CONDITIONS AND AUTOIMMUNE DISEASES WITH GLUCOSE UPTAKE INHIBITORS SLC2A3, SLC2A4, SLC2A1 MAPT 1704/4885SMN1; SMN2 3512/4885RAB9A 1218/4885
US-20240360085-A1 Glucose Uptake Inhibitors SLC2A3, SLC2A1, SLC2A4 MAPT 1717/4885SMN1; SMN2 3677/4885RAB9A 1198/4885

“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.