SCHEMBL29675198

SCHEMBL29675198

COc1ccc(NC(=O)NC(=O)COc2ccc3c(c2)OCO3)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.69
NPC1 O15118 7/20 0.69
KMT2A Q03164 6/20 0.66
MEN1 O00255 2/20 0.57
MAPT P10636 2/20 0.56
RXFP1 Q9HBX9 1/20 0.55
PKM P14618 1/20 0.53
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL19538014 1.00 RAB9A (0.69) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL29675037 0.81 NPC1 (0.59) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL19520633 0.81 NPC1 (0.59) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL20931218 0.78 NPC1 (0.67) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL19538025 0.78 ALDH1A1 (0.64) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL19537834 0.78 RAB9A (0.85) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL29675160 0.78 ALDH1A1 (0.64) RAB9ANPC1KMT2AMAPTALDH1A1
SCHEMBL29894011 0.78 RAB9A (0.85) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL20931214 0.78 RXFP1 (0.69) RAB9ANPC1KMT2AMEN1MAPT
SCHEMBL29894125 0.78 RXFP1 (0.69) RAB9ANPC1KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153655-B Novel N-acylurea derivatives and compositions comprising the same for preventing or treating cardiovascular diseases 高丽大学校产学协力团 2022-09-30 CN claimed
CN-109153655-B Novel N-acylurea derivatives and compositions comprising the same for preventing or treating cardiovascular diseases 高丽大学校产学协力团 2022-09-30 CN disclosed
US-20220194928-A1 NOVEL N-ACYLUREA DERIVATIVE AND COMPOSITION COMPRISING SAME FOR PREVENTION OR TREATMENT OF CARDIOVASCULAR DISEASE UNIV KOREA RES & BUS FOUND (KR) 2022-06-23 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 (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-20220194928-A1 NOVEL N-ACYLUREA DERIVATIVE AND COMPOSITION COMPRISING SAME FOR PREVENTION OR TREATMENT OF CARDIOVASCULAR DISEASE TLN1, TNNI3, PTK2 RAB9A 1229/4885NPC1 1523/4885KMT2A 2470/4885

“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.