SCHEMBL22633335

SCHEMBL22633335

COC(=O)c1cccc(C(O)CCC(C)C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
CYP1A2 P05177 3/20 0.42
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
RECQL P46063 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
RAB9A P51151 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
FAAH O00519 1/20 0.40
GRM5 P41594 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MRGPRX4 Q96LA9 2/20 0.38
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL22633363 0.84 CYP1A2 (0.44) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL22235165 0.84 MAPT (0.44) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL29316554 0.83 FAAH (0.46) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL16834536 0.82 MAPT (0.48) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL179305 0.80 MAPT (0.49) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL18879240 0.78 CYP1A2 (0.45) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL18672435 0.78 CYP1A2 (0.47) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL22931516 0.77 MAPT (0.47) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL14825313 0.77 MAPT (0.50) MAPTCYP1A2GAASMN1; SMN2RECQL
SCHEMBL6117583 0.77 MAPT (0.50) MAPTCYP1A2GAASMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12453785-B2 Macrocyclic chelators and methods of use thereof JANSSEN BIOTECH, INC. (US) 2025-10-28 US disclosed
US-20230110178-A1 Macrocyclic Chelators and Methods of Use Thereof JANSSEN BIOTECH, INC. 2023-04-13 US disclosed
US-11576986-B2 Macrocyclic chelators and methods of use thereof JANSSEN BIOTECH, INC. (US) 2023-02-14 US disclosed
US-11576986-B2 Macrocyclic chelators and methods of use thereof JANSSEN BIOTECH, INC. (US) 2023-02-14 US disclosed
CN-114127059-A Macrocyclic chelants and methods of use thereof 詹森生物科技公司 2022-03-01 CN disclosed
WO-2020229974-A1 MACROCYCLIC CHELATORS AND METHODS OF USE THEREOF JANSSEN BIOTECH, INC. (US) 2020-11-19 WO disclosed
US-20200353105-A1 Macrocyclic Chelators and Methods of Use Thereof JANSSEN BIOTECH, INC. 2020-11-12 US disclosed
US-20200353105-A1 Macrocyclic Chelators and Methods of Use Thereof JANSSEN BIOTECH, INC. 2020-11-12 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 (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-20200353105-A1 Macrocyclic Chelators and Methods of Use Thereof CLASP1, CLTC, CD47 MAPT 2830/4885CYP1A2 4570/4885GAA 325/4885
US-11576986-B2 Macrocyclic chelators and methods of use thereof CLASP1, CLTC, CD47 MAPT 2830/4885CYP1A2 4570/4885GAA 325/4885
US-20230110178-A1 Macrocyclic Chelators and Methods of Use Thereof CLASP1, CLTC, CD47 MAPT 2830/4885CYP1A2 4570/4885GAA 325/4885
US-12453785-B2 Macrocyclic chelators and methods of use thereof CLASP1, CLTC, CD47 MAPT 2830/4885CYP1A2 4570/4885GAA 325/4885

“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.