SCHEMBL7260971

SCHEMBL7260971

Oc1c(O)c2[nH]c1c(-c1ccccc1)c1nc(c(-c3ccccc3)c3ccc([nH]3)c(-c3ccccc3)c3nc(c2-c2ccccc2)CC3)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.36
▸ STAT3 P40763 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ CDK4 P11802 4/20 0.34
▸ CCND1 P24385 4/20 0.34
▸ TOP1 P11387 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ CYCS P99999 2/20 0.33
▸ F2 P00734 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAU P00749 1/20 0.33
▸ PLAT P00750 1/20 0.33
▸ KLKB1 P03952 1/20 0.33
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ F7 P08709 1/20 0.33
▸ PRSS3 P35030 1/20 0.33
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33

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
SCHEMBL1419546 0.87 STAT3 (0.41) MAPTSTAT3STAT1TOP1KDM4E
SCHEMBL1315604 0.79 TOP1 (0.37) STAT3STAT1TOP1CYCS
SCHEMBL4413776 0.78 TOP1 (0.53) STAT3STAT1TOP1CYCS
SCHEMBL16270682 0.77 CYCS (0.54) STAT3STAT1TOP1CYCS
SCHEMBL31167372 0.75 RIPK1 (0.43) MAPTCDK4CCND1KDM4EESR1
SCHEMBL498511 0.75 RIPK1 (0.43) MAPTCDK4CCND1KDM4EESR1
SCHEMBL14181439 0.74 STAT3 (0.46) STAT3STAT1CDK4CCND1TOP1
SCHEMBL15258311 0.72 TOP1 (0.65) TOP1KDM4ECYCS
SCHEMBL17934754 0.72 TOP1 (0.75) STAT3STAT1TOP1KDM4ECYCS
SCHEMBL19326350 0.71 TOP1 (0.49) STAT3STAT1TOP1CYCS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0804439-B1 BETA, BETA '-DIHYDROXY MESO-SUBSTITUTED CHLORINS, ISOBACTERIOCHLORINS, BACTERIOCHLORINS, AND METHODS FOR MAKING THE SAME FROM BETA ,BETA '-UNSUBSTITUTED TETRAPYRROLIC MACROCYCLES UNIV BRITISH COLUMBIA (CA) 2003-09-17 — — EP disclosed
US-5831088-A OSMYLATION THE UNIVERSITY OF BRITISH COLUMBIA (CA) 1998-11-03 — — US disclosed
EP-0804439-A1 BETA, BETA '-DIHYDROXY MESO-SUBSTITUTED CHLORINS, ISOBACTERIOCHLORINS, BACTERIOCHLORINS, AND METHODS FOR MAKING THE SAME FROM BETA ,BETA '-UNSUBSTITUTED TETRAPYRROLIC MACROCYCLES UNIVERSITY OF BRITISH COLUMBIA (CA) 1997-11-05 — — EP disclosed
US-5648485-A PORPHYRIN COMPOUNDS UNIVERSITY OF BRITISH COLUMBIA (CA) 1997-07-15 — — US disclosed
WO-1996013504-A1 β,β'-DIHYDROXY MESO-SUBSTITUTED CHLORINS, ISOBACTERIOCHLORINS, BACTERIOCHLORINS, AND METHODS FOR MAKING THE SAME FROM β,β'-UNSUBSTITUTED TETRAPYRROLIC MACROCYCLES UNIVERSITY OF BRITISH COLUMBIA (CA) 1996-05-09 — — WO disclosed
Send feedback