SCHEMBL6581338

SCHEMBL6581338

COc1ccc2cc(-c3oc4ccccc4c3CCC3CCCC3)ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.41
MTNR1B P49286 7/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
ABCG2 Q9UNQ0 2/20 0.40
KDM4E B2RXH2 4/20 0.39
CYP3A4 P08684 4/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 3/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
TSHR P16473 2/20 0.39
CYP2C19 P33261 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
TP53 P04637 2/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
ALDH1A1 P00352 3/20 0.39

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
SCHEMBL6582700 0.85 PTPN1 (0.42) MEN1KMT2AKDM4ECYP3A4MAPT
SCHEMBL6585145 0.80 CNR1 (0.47) MTNR1AMTNR1BMEN1KMT2ACNR1
SCHEMBL6581972 0.78 PTPN1 (0.46) MEN1KMT2AKDM4ECYP3A4MAPT
SCHEMBL6582058 0.78 ALDH1A1 (0.41) MEN1KMT2ACNR1CNR2ABCG2
SCHEMBL6582364 0.78 CNR2 (0.52) MEN1KMT2ACNR1CNR2KDM4E
SCHEMBL6582969 0.75 PTPN1 (0.39) MEN1KMT2AMAPTTSHRTP53
SCHEMBL6580067 0.74 PTPN1 (0.53) KMT2AKDM4ETSHRALDH1A1L3MBTL1
SCHEMBL6583282 0.73 PTPN1 (0.46) MEN1KMT2AKDM4EMAPTHPGD
SCHEMBL7011599 0.71 MTNR1A (0.50) MTNR1AMTNR1BMEN1KMT2AABCG2
SCHEMBL6579482 0.70 L3MBTL1 (0.56) MEN1KMT2ACNR1CNR2KDM4E

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-1401822-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2004-03-31 EP disclosed
US-6599925-B2 Cardiovascular disorders; anticancer agents WYETH 2003-07-29 US disclosed
US-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) WYETH 2003-01-23 US disclosed
WO-2003000671-A1 NAPHTHYL BENZOFURAN DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2003-01-03 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-20030018067-A1 Substituted naphthyl benzofuran derivatives as inhibitors of plasminogen activator inhibitor-1 (PAI-1) F2R, SERPINE1, SERPINC1 MTNR1A 1765/4885MTNR1B 2054/4885MEN1 4849/4885

“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.