SCHEMBL3324591

SCHEMBL3324591

O=C(O)c1c(Nc2ccc(Cl)cc2Cl)[nH]c2c(Cl)cc(Cl)cc2c1=O

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 8/20 0.62
CTSB P07858 7/20 0.62
CTSL P07711 6/20 0.62
CTSH P09668 3/20 0.62
CTSD P07339 1/20 0.62
LIN28A Q9H9Z2 2/20 0.60
KCNH2 Q12809 2/20 0.40
TSHR P16473 1/20 0.38
CASP1 P29466 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
BCL6 P41182 1/20 0.36
BCOR Q6W2J9 1/20 0.36
PYGL P06737 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL497135 0.88 CAPN1 (0.60) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL3326999 0.84 CAPN1 (0.52) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL497311 0.81 CAPN1 (0.51) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL20094419 0.74 CAPN1 (0.81) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL24185944 0.73 CAPN1 (0.60) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL30668259 0.73 CAPN1 (0.60) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL30668243 0.73 CAPN1 (0.59) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL30668241 0.73 CAPN1 (0.59) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL24186183 0.73 CAPN1 (0.59) CAPN1CTSBCTSLCTSHCTSD
SCHEMBL22003072 0.72 CAPN1 (1.00) CAPN1CTSBCTSLCTSHCTSD

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
EP-2124948-B1 COMPOSITIONS FOR TREATING HYPERPROLIFERATIVE VASCULAR DISORDERS AND CANCERS NC BIT INC (KR) 2017-07-26 EP disclosed
US-20100120849-A1 Compositions for Treating Hyperproliferative Vascular Disorders and Cancers BIOBUD CO., LTD (KR) 2010-05-13 US disclosed
EP-2124948-A1 COMPOSITIONS FOR TREATING HYPERPROLIFERATIVE VASCULAR DISORDERS AND CANCERS Biobud Co., Ltd. (KR) 2009-12-02 EP disclosed
WO-2008102932-A1 COMPOSITIONS FOR TREATING HYPERPROLIFERATIVE VASCULAR DISORDERS AND CANCERS BIOBUD CO., LTD. (KR) 2008-08-28 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-20100120849-A1 Compositions for Treating Hyperproliferative Vascular Disorders and Cancers MKI67, MYLK, PCNA CAPN1 4329/4885CTSB 3153/4885CTSL 4783/4885

“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.