SCHEMBL29675160

SCHEMBL29675160

COc1ccc(CNC(=O)NC(=O)COc2ccc3c(c2)OCO3)cc1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.64
ABCG2 Q9UNQ0 1/20 0.59
HPGD P15428 2/20 0.57
KMT2A Q03164 1/20 0.57
MCHR1 Q99705 1/20 0.56
RAB9A P51151 2/20 0.56
NPC1 O15118 1/20 0.56
HSD17B10 Q99714 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 2/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL19538025 1.00 ALDH1A1 (0.64) ALDH1A1ABCG2HPGDKMT2AMCHR1
SCHEMBL107309 0.82 HPGD (0.81) ALDH1A1ABCG2HPGDKMT2ARAB9A
SCHEMBL1042327 0.80 RAB9A (0.78) ALDH1A1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL29675198 0.78 RAB9A (0.69) ALDH1A1KMT2ARAB9ANPC1MAPT
SCHEMBL19538014 0.78 RAB9A (0.69) ALDH1A1KMT2ARAB9ANPC1MAPT
SCHEMBL108077 0.78 LMNA (0.72) ALDH1A1HPGDKMT2ARAB9ANPC1
SCHEMBL24355627 0.76 HPGD (0.78) ALDH1A1ABCG2HPGDKMT2ANPC1
SCHEMBL5007270 0.75 KDM4E (0.66) ALDH1A1HPGDKMT2ARAB9ANPC1
SCHEMBL19538016 0.75 GAA (0.56) ALDH1A1KMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL5338191 0.74 MEN1 (0.80) ALDH1A1HPGDKMT2ARAB9ANPC1

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 ALDH1A1 2072/4885ABCG2 2617/4885HPGD 3550/4885

“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.