SCHEMBL22834041

SCHEMBL22834041

CC(C)CC(NC(=O)C(CCCCNC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
CPB1 P15086 1/20 0.59
CPB2 Q96IY4 1/20 0.59
KLK7 P49862 2/20 0.59
KLK5 Q9Y337 2/20 0.59
FOLH1 Q04609 1/20 0.56
CAPN1 P07384 1/20 0.55
CAPN2 P17655 1/20 0.55

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
SCHEMBL22834040 1.00 MAPT (0.59) MAPTCPB1CPB2KLK7KLK5
SCHEMBL7316805 0.93 MAPT (0.64) MAPTCPB1CPB2KLK7KLK5
SCHEMBL21219294 0.93 REN (0.57) MAPTCPB1CPB2KLK7KLK5
SCHEMBL21219296 0.93 REN (0.57) MAPTCPB1CPB2KLK7KLK5
SCHEMBL21981385 0.93 CAPN1 (0.59) CPB1CPB2FOLH1CAPN1CAPN2
SCHEMBL24130643 0.92 KLK7 (0.59) MAPTKLK7KLK5CAPN1CAPN2
SCHEMBL24130639 0.92 KLK7 (0.59) MAPTKLK7KLK5CAPN1CAPN2
SCHEMBL17039826 0.89 FOLH1 (0.60) MAPTCPB1CPB2KLK7KLK5
SCHEMBL21981425 0.89 CAPN1 (0.58) CPB1CPB2CAPN1CAPN2
SCHEMBL21981423 0.89 CAPN1 (0.58) CPB1CPB2CAPN1CAPN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590123-B2 Compounds and methods for treating cancer, viral infections, and allergic conditions WASHINGTON UNIVERSITY (US) 2026-03-31 US disclosed
US-20220380407-A1 COMPOUNDS AND METHODS FOR TREATING CANCER, VIRAL INFECTIONS, AND ALLERGIC CONDITIONS WASHINGTON UNIVERSITY (US) 2022-12-01 US disclosed
EP-3989997-A1 COMPOUNDS AND METHODS FOR TREATING CANCER, VIRAL INFECTIONS, AND ALLERGIC CONDITIONS Washington University (US) 2022-05-04 EP disclosed
WO-2020264187-A1 COMPOUNDS AND METHODS FOR TREATING CANCER, VIRAL INFECTIONS, AND ALLERGIC CONDITIONS JANETKA JAMES (US) 2020-12-30 WO 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-12590123-B2 Compounds and methods for treating cancer, viral infections, and allergic conditions TMPRSS2, TMPRSS4, F2RL3 MAPT 3390/4885CPB1 134/4885CPB2 112/4885
US-20220380407-A1 COMPOUNDS AND METHODS FOR TREATING CANCER, VIRAL INFECTIONS, AND ALLERGIC CONDITIONS TMPRSS2, PRSS1, PRSS2 MAPT 1977/4885CPB1 87/4885CPB2 88/4885

“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.