SCHEMBL7123254

SCHEMBL7123254

CC(=O)NC([C]=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSC P53634 3/20 0.58
ALOX15 P16050 1/20 0.56
TACR1 P25103 4/20 0.56
KDM4E B2RXH2 1/20 0.56
APAF1 O14727 1/20 0.56
POLB P06746 1/20 0.56
MAPT P10636 1/20 0.56
RECQL P46063 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ACE P12821 2/20 0.55
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
PKM P14618 1/20 0.54
TSHR P16473 1/20 0.54
CYP2C19 P33261 1/20 0.54
BLM P54132 1/20 0.54
KMT2A Q03164 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
CTSL P07711 1/20 0.53

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
SCHEMBL12098384 1.00 CTSC (0.58) CTSCALOX15TACR1KDM4EAPAF1
SCHEMBL11016805 0.92 CTSC (0.58) CTSCALOX15TACR1KDM4EAPAF1
SCHEMBL11016794 0.92 CTSC (0.58) CTSCALOX15TACR1KDM4EAPAF1
SCHEMBL10805307 0.87 CTSC (0.58) CTSCKDM4EAPAF1POLBMAPT
SCHEMBL10805302 0.87 CTSC (0.58) CTSCKDM4EAPAF1POLBMAPT
SCHEMBL7396949 0.86 EDNRA (0.54) CTSCTACR1KDM4EAPAF1POLB
SCHEMBL27871540 0.85 CTSC (0.64) CTSCTACR1KDM4EAPAF1POLB
SCHEMBL8385505 0.84 CTSC (0.81) CTSCKDM4EAPAF1POLBMAPT
SCHEMBL11599237 0.84 CTSC (0.66) CTSCKDM4EAPAF1POLBMAPT
SCHEMBL10791529 0.84 CTSC (0.81) CTSCKDM4EAPAF1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6660858-B2 Made by reacting a benzoxazole with a leaving group at the 2 position and a diamine of given formula LION BIOSCIENCE AG (DE) 2003-12-09 US claimed
US-20020161028-A1 2-aminobenzoxazole derivatives and combinatorial libraries thereof LION BIOSCIENCE, AG (DE) 2002-10-31 US claimed
WO-2002079753-A2 2-AMINOBENZOXAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2002-10-10 WO claimed
US-6660858-B2 Made by reacting a benzoxazole with a leaving group at the 2 position and a diamine of given formula LION BIOSCIENCE AG (DE) 2003-12-09 US disclosed
US-20020161028-A1 2-aminobenzoxazole derivatives and combinatorial libraries thereof LION BIOSCIENCE, AG (DE) 2002-10-31 US disclosed
WO-2002079753-A2 2-AMINOBENZOXAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2002-10-10 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 (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-20020161028-A1 2-aminobenzoxazole derivatives and combinatorial libraries thereof BCAT2, IL4I1, BCAT1 CTSC 3071/4885ALOX15 3738/4885TACR1 4441/4885

“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.