SCHEMBL25811699

SCHEMBL25811699

COC(=O)C(C)c1cccc(C(=O)OCc2ccccc2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 3/20 0.67
PTGS2 P35354 3/20 0.67
RAB9A P51151 7/20 0.57
KMT2A Q03164 4/20 0.56
TDP1 Q9NUW8 2/20 0.56
SLC6A2 P23975 1/20 0.56
SLC6A3 Q01959 1/20 0.56
NPC1 O15118 4/20 0.51
SMN1; SMN2 Q16637 6/20 0.50
ALDH1A1 P00352 5/20 0.50
MAPT P10636 5/20 0.50
LMNA P02545 4/20 0.50
KDM4E B2RXH2 3/20 0.49
MEN1 O00255 1/20 0.48
HPGD P15428 2/20 0.47
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
RECQL P46063 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPK1 P28482 1/20 0.47

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
SCHEMBL25811695 0.87 PTGS1 (0.64) PTGS1PTGS2RAB9AKMT2ATDP1
SCHEMBL15614360 0.86 TDP1 (0.63) RAB9AKMT2ATDP1SLC6A2SLC6A3
SCHEMBL31455652 0.85 KMT2A (0.61) PTGS1PTGS2RAB9AKMT2ATDP1
SCHEMBL31218041 0.84 TDP1 (0.59) RAB9AKMT2ATDP1SLC6A2SLC6A3
SCHEMBL30760639 0.84 TDP1 (0.59) RAB9AKMT2ATDP1SLC6A2SLC6A3
SCHEMBL9030430 0.83 PTGS1 (0.72) PTGS1PTGS2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL19788501 0.82 TDP1 (0.65) RAB9AKMT2ATDP1SLC6A2SLC6A3
SCHEMBL27337757 0.82 KMT2A (0.69) RAB9AKMT2ATDP1SLC6A2SLC6A3
SCHEMBL16830125 0.81 PTGS2 (0.70) PTGS1PTGS2KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9086931 0.80 PTGS1 (1.00) PTGS1PTGS2KMT2ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed
US-20230219961-A1 Pyridine acetamide derivative serving as CDK inhibitor, and preparation method therefor and use thereof Suzhou Alphama Biotechnology Co., Ltd. (CN) 2023-07-13 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-20230219961-A1 Pyridine acetamide derivative serving as CDK inhibitor, and preparation method therefor and use thereof CDK9, CDK7, CDK8 PTGS1 1205/4885PTGS2 2365/4885RAB9A 1987/4885

“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.