SCHEMBL9438544

SCHEMBL9438544

CN1C=CC(c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(C4=CCN(C)C=C4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)=CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.47
STAT3 P40763 1/20 0.43
STAT1 P42224 1/20 0.43
TOP1 P11387 4/20 0.43
CYCS P99999 3/20 0.42
ENPP2 Q13822 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.37

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
SCHEMBL6759942 1.00 TERT (0.47) TERTSTAT3STAT1TOP1CYCS
SCHEMBL2535689 1.00 TERT (0.47) TERTSTAT3STAT1TOP1CYCS
SCHEMBL7150430 1.00 TERT (0.47) TERTSTAT3STAT1TOP1CYCS
Hydrochloric Acid SCHEMBL8182742 0.99 TERT (0.46) TERTSTAT3STAT1TOP1CYCS
Hydrochloric Acid SCHEMBL8182065 0.99 TERT (0.46) TERTSTAT3STAT1TOP1CYCS
SCHEMBL18418 0.91 TERT (0.44) TERTTOP1CYCSENPP2
Hydrochloric Acid SCHEMBL7246124 0.90 TERT (0.43) TERTTOP1CYCSENPP2
Hydrochloric Acid SCHEMBL4138914 0.90 TERT (0.43) TERTTOP1CYCSENPP2
Hydrochloric Acid SCHEMBL30474599 0.90 TERT (0.43) TERTTOP1CYCSENPP2
SCHEMBL2375486 0.90 TERT (0.43) TERTTOP1CYCSENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5281616-A Treatment of human immunodeficiency virus infections GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1994-01-25 US disclosed
US-5109016-A Method for inhibiting infection or replication of human immunodeficiency virus with porphyrin and phthalocyanine antiviral compositions GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1992-04-28 US disclosed
WO-1989011277-A2 PORPHYRIN AND PHTHALOCYANINE ANTIVIRAL COMPOSITIONS GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1989-11-30 WO disclosed