SCHEMBL22801145

SCHEMBL22801145

Cc1ccc(N)c(CO[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 2/20 0.38
TP53 P04637 1/20 0.38
THRB P10828 1/20 0.38
TAAR1 Q96RJ0 1/20 0.36
BACE1 P56817 1/20 0.34
ALDH1A1 P00352 4/20 0.33
ATP4A P20648 3/20 0.33
ATP4B P51164 3/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.33
IDO1 P14902 2/20 0.32

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
SCHEMBL22801148 0.87 TDP1 (0.38) CYP3A4TDP1SMN1; SMN2ALOX15TP53
SCHEMBL4996802 0.83 IDO1 (0.38) CYP3A4TDP1SMN1; SMN2ALOX15TP53
SCHEMBL1922648 0.83 APLNR (0.35) SMN1; SMN2BACE1ALDH1A1NPC1RAB9A
SCHEMBL1289637 0.81 IDO1 (0.44) CYP3A4TDP1SMN1; SMN2THRBTAAR1
SCHEMBL28530955 0.81 AMY1A (0.45) TDP1ALOX15TP53BACE1ALDH1A1
SCHEMBL19915790 0.79 FNTA (0.34) BACE1ALDH1A1MAPT
SCHEMBL3940682 0.78 BACE1 (0.44) BACE1ALDH1A1IDO1
SCHEMBL2103775 0.78 HTT (0.44) CYP3A4TDP1SMN1; SMN2ALOX15THRB
SCHEMBL22801136 0.76 KDM4E (0.46) CYP3A4SMN1; SMN2ALOX15TP53BACE1
SCHEMBL22822209 0.76 BACE1 (0.32) CYP3A4BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2020-12-24 US disclosed
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2020-12-24 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 (2 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-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity GUSB, NTPCR, FOLH1 CYP3A4 489/4885TDP1 358/4885SMN1; SMN2 3375/4885
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY GUSB, NTPCR, FOLH1 CYP3A4 489/4885TDP1 358/4885SMN1; SMN2 3375/4885

“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.