SCHEMBL20284039

SCHEMBL20284039

CC(C)=CC(=O)Nc1ccc(O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.70
▸ RAB9A P51151 5/20 0.70
▸ SMN1; SMN2 Q16637 4/20 0.70
▸ GAA P10253 3/20 0.70
▸ TSHR P16473 2/20 0.70
▸ NFKB1 P19838 2/20 0.70
▸ NFKB2 Q00653 2/20 0.70
▸ RELA Q04206 2/20 0.70
▸ HTT P42858 1/20 0.70
▸ DEGS1 O15121 2/20 0.65
▸ MAPT P10636 4/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ CA12 O43570 1/20 0.61
▸ BRD4 O60885 1/20 0.61
▸ NR1I2 O75469 1/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ CA1 P00915 1/20 0.61
▸ CA2 P00918 1/20 0.61
▸ MB P02144 1/20 0.61

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
SCHEMBL11048872 0.85 DEGS1 (0.61) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL3713301 0.84 NPC1 (0.70) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL2998577 0.82 SMN1; SMN2 (1.00) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL5645657 0.82 SMN1; SMN2 (0.68) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL17675351 0.82 SMN1; SMN2 (0.68) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL11759969 0.82 SMN1; SMN2 (0.68) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL4135335 0.82 NPC1 (1.00) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL396577 0.82 SMN1; SMN2 (0.67) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL7679084 0.82 SMN1; SMN2 (0.67) NPC1RAB9ASMN1; SMN2GAATSHR
SCHEMBL2205368 0.79 TGM2 (0.67) NPC1RAB9ASMN1; SMN2GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11771684-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2023-10-03 — — US disclosed
US-11771684-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2023-10-03 — — US disclosed
US-11771684-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2023-10-03 — — US disclosed
CN-112442013-B Compound serving as thyroid hormone beta receptor agonist and application thereof 广东东阳光药业有限公司 2022-07-26 — — CN disclosed
US-20220079926-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CENTAURUS THERAPEUTICS 2022-03-17 — — US disclosed
US-11135207-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2021-10-05 — — US disclosed
US-11135207-B2 Inhibitors of dihydroceramide desaturase for treating disease CENTAURUS THERAPEUTICS (US) 2021-10-05 — — US disclosed
WO-2021043185-A1 A COMPOUND AS A THYROID HORMONE BETA RECEPTOR AGONIST AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-03-11 — — WO disclosed
US-20190328720-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CENTAURUS THERAPEUTICS 2019-10-31 — — US disclosed
US-20190328720-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CENTAURUS THERAPEUTICS 2019-10-31 — — US disclosed
WO-2018112077-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CENTAURUS THERAPEUTICS (US) 2018-06-21 — — 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 (4 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-20220079926-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CERS2, DEGS1, SMPD1 NPC1 59/4885RAB9A 952/4885SMN1; SMN2 588/4885
US-11771684-B2 Inhibitors of dihydroceramide desaturase for treating disease CERS2, DEGS1, SMPD1 NPC1 59/4885RAB9A 952/4885SMN1; SMN2 588/4885
US-11135207-B2 Inhibitors of dihydroceramide desaturase for treating disease CERS2, DEGS1, SMPD1 NPC1 59/4885RAB9A 952/4885SMN1; SMN2 588/4885
US-20190328720-A1 INHIBITORS OF DIHYDROCERAMIDE DESATURASE FOR TREATING DISEASE CERS2, DEGS1, SMPD1 NPC1 59/4885RAB9A 952/4885SMN1; SMN2 588/4885

“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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