SCHEMBL7052111

SCHEMBL7052111

CCOC(=O)C(CCc1ccccc1)C(CSc1c(OCC)ccc2ccccc12)[PH2]=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 3/20 0.36
AVPR1A P37288 1/20 0.36
AVPR1B P47901 1/20 0.36
POLB P06746 2/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 2/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
AKR1C3 P42330 1/20 0.34

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
SCHEMBL7052126 0.95 KMT2A (0.36) NPSR1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7051259 0.91 AVPR1A (0.37) MEN1KMT2ALMNAAVPR1AAVPR1B
SCHEMBL7050182 0.86 MAPK1 (0.37) MEN1KMT2ALMNAKDM4EMAPT
SCHEMBL7049843 0.84 SMN1; SMN2 (0.41) NPSR1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7054021 0.81 ALDH1A1 (0.39) NPSR1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL7047039 0.79 KMT2A (0.39) NPSR1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL7047065 0.76 USP2 (0.39) SMN1; SMN2MEN1KMT2AKDM4EHPGD
SCHEMBL7052863 0.74 MMP8 (0.39) SMN1; SMN2LMNAPOLBMAPTALDH1A1
SCHEMBL9067046 0.74 SMN1; SMN2 (0.41) SMN1; SMN2KMT2AHPGDMAPTALDH1A1
SCHEMBL9067045 0.74 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ALMNAPOLB

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-20030212067-A1 Matrix metalloprotease inhibitors CASTELHANO ARLINDO LUCAS (US) 2003-11-13 US disclosed
US-6579890-B1 Matrix metalloprotease inhibitors SYNTEX (U.S.A.) INC. 2003-06-17 US disclosed
US-6037472-A FOR TREATING DISEASE-STATES CHARACTERIZED BY EXCESSIVE ACTIVITY OF MATRIX METALLOPROTEASES SUCH AS RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, PERIODONTAL DISEASE, ABERRANT ANGIOGENESIS, TUMOR INVASION AND METASTASIS SYNTEX (U.S.A.) INC. (US) 2000-03-14 US disclosed
EP-0793643-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1997-09-10 EP disclosed
EP-0726903-B1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1997-07-16 EP disclosed
WO-1996016027-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-05-30 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 (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-20030212067-A1 Matrix metalloprotease inhibitors MMP7, MMP1, MMP3 NPSR1 2293/4885SMN1; SMN2 305/4885MEN1 499/4885

“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.