SCHEMBL30306844

SCHEMBL30306844

CCCCCCNC(=O)[C@@H](N)Cc1nc2cc(C(=O)OCc3ccccc3)ccc2o1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.46
▸ NPC1 O15118 2/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MAPT P10636 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ SIRT2 Q8IXJ6 7/20 0.41
▸ SIRT1 Q96EB6 5/20 0.41
▸ SIRT3 Q9NTG7 5/20 0.41
▸ TP53 P04637 2/20 0.41

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
SCHEMBL25023565 0.93 RAB9A (0.44) RAB9ANPC1MEN1ALDH1A1HPGD
SCHEMBL30306801 0.87 MEN1 (0.49) RAB9ANPC1MEN1ALDH1A1HPGD
SCHEMBL28968969 0.87 MEN1 (0.49) RAB9ANPC1MEN1ALDH1A1HPGD
SCHEMBL25023561 0.87 MEN1 (0.49) RAB9ANPC1MEN1ALDH1A1HPGD
SCHEMBL28969006 0.86 RAB9A (0.43) RAB9ANPC1
SCHEMBL25023560 0.83 RAB9A (0.46) RAB9ANPC1MEN1ALDH1A1HPGD
SCHEMBL30306748 0.81 TLR2 (0.43) MEN1ALDH1A1HPGDKMT2ASIRT2
SCHEMBL24073357 0.78 RAB9A (0.43) RAB9ANPC1ALDH1A1KMT2AMAPT
SCHEMBL25023564 0.76 RAB9A (0.44) RAB9ANPC1MAPTLMNATP53
SCHEMBL24073353 0.74 RAB9A (0.46) RAB9ANPC1ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240156780-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2024-05-16 — — US disclosed
US-11951094-B2 TLR2 modulator compounds, pharmaceutical compositions and uses thereof AXIAL THERAPEUTICS, INC. (US) 2024-04-09 — — US disclosed
EP-4171547-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF Axial Therapeutics, Inc. (US) 2023-05-03 — — EP disclosed
US-20230051773-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF AXIAL THERAPEUTICS, INC. (US) 2023-02-16 — — 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 (3 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-20230051773-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF TLR2, TLR3, TLR4 RAB9A 4207/4885NPC1 1746/4885MEN1 4682/4885
US-20240156780-A1 TLR2 MODULATOR COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF TLR2, TLR3, TLR4 RAB9A 4207/4885NPC1 1746/4885MEN1 4682/4885
US-11951094-B2 TLR2 modulator compounds, pharmaceutical compositions and uses thereof TLR2, TLR3, TLR4 RAB9A 4207/4885NPC1 1746/4885MEN1 4682/4885

“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.

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