SCHEMBL7050285

SCHEMBL7050285

O=[PH2]C(CSc1c(O)ccc2ccccc12)C(CC1CCCCC1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 2/20 0.38
ALDH1A1 P00352 4/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
METAP2 P50579 5/20 0.37
METAP1 P53582 3/20 0.37
USP2 O75604 1/20 0.36
PAK1 Q13153 1/20 0.36
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 2/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36
GLA P06280 1/20 0.35
MEN1 O00255 3/20 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
SCHEMBL7046960 0.81 ALDH1A1 (0.38) ALDH1A1HSD17B10METAP2METAP1HPGD
SCHEMBL7049051 0.81 USP2 (0.40) ACP3ALDH1A1HSD17B10USP2PAK1
SCHEMBL7051271 0.80 USP2 (0.40) ALDH1A1HSD17B10USP2PAK1KDM4E
SCHEMBL7047065 0.79 USP2 (0.39) ALDH1A1HSD17B10METAP2METAP1USP2
SCHEMBL7052123 0.78 USP2 (0.37) ALDH1A1HSD17B10CYP1A2CYP2D6CYP2C19
SCHEMBL9067414 0.69 PRNP (0.48) ALDH1A1HIF1AKDM4ELMNAGAA
SCHEMBL19690672 0.62 SLC1A3 (0.43) CYP2D6LMNA
SCHEMBL25910728 0.60 HSD17B10 (0.59) ALDH1A1HSD17B10CYP1A2CYP2D6CYP2C9
SCHEMBL5534127 0.59 CHRNB2 (0.50) ACP3METAP2METAP1RAB9AMEN1
SCHEMBL7052059 0.59 FCER2 (0.35) MMP1MMP2

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 ACP3 708/4885ALDH1A1 465/4885HSD17B10 426/4885

“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.