SCHEMBL22772409

SCHEMBL22772409

CCNC(=O)C(=O)[C@@H]1CC=CCCCCCCCc2ccccc2C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F11 P03951 2/20 0.39
ALDH1A1 P00352 1/20 0.38
CTSL P07711 2/20 0.35
TSHR P16473 1/20 0.34
MTNR1A P48039 1/20 0.34
MME P08473 6/20 0.34
ACE P12821 3/20 0.34
LNPEP Q9UIQ6 2/20 0.34
CYP2A6 P11509 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
SHH Q15465 2/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 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
SCHEMBL22772406 1.00 F11 (0.39) F11ALDH1A1CTSLTSHRMTNR1A
SCHEMBL22772408 1.00 F11 (0.39) F11ALDH1A1CTSLTSHRMTNR1A
SCHEMBL22772398 1.00 F11 (0.39) F11ALDH1A1CTSLTSHRMTNR1A
SCHEMBL22772407 0.87 MME (0.41) F11ALDH1A1TSHRMTNR1AMME
SCHEMBL22800060 0.87 MME (0.41) F11ALDH1A1TSHRMTNR1AMME
SCHEMBL22772401 0.87 MME (0.41) F11ALDH1A1TSHRMTNR1AMME
SCHEMBL22799785 0.83 ALDH1A1 (0.36) F11ALDH1A1CTSLTSHRMTNR1A
SCHEMBL22800054 0.83 ALDH1A1 (0.36) F11ALDH1A1CTSLTSHRMTNR1A
SCHEMBL22800232 0.81 MME (0.45) F11ALDH1A1CTSLTSHRMME
SCHEMBL22799762 0.81 CYP1A2 (0.40) F11ALDH1A1TSHRMMEACE

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
US-11292801-B2 Calpain modulators and therapeutic uses thereof BLADE THERAPEUTICS, INC. (US) 2022-04-05 US disclosed
US-20200392157-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF Knobbe, Martens, Olson & Bear, LLP 2020-12-17 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-20200392157-A1 CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF CAPNS1, CAPN2, CAPN1 F11 4722/4885ALDH1A1 3918/4885CTSL 313/4885
US-11292801-B2 Calpain modulators and therapeutic uses thereof CAPNS1, CAPN2, CAPN1 F11 4722/4885ALDH1A1 3918/4885CTSL 313/4885

“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.