SCHEMBL28807790

SCHEMBL28807790

O=C(O)c1ccc(C2=CC3=CC4=NC(=CC5=NC(=CC6=NC(=CC2=N3)C=C6)C=C5)C=C4)cc1.[Co]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 1/20 0.33
▸ BAD Q92934 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ TOP1 P11387 1/20 0.32
▸ MKNK1 Q9BUB5 1/20 0.32
▸ MKNK2 Q9HBH9 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYCS P99999 2/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ RXRA P19793 2/20 0.31
▸ RXRB P28702 2/20 0.31
▸ SRD5A2 P31213 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31
▸ CSNK2B P67870 1/20 0.31
▸ CSNK2A1 P68400 1/20 0.31
▸ GRIK1 P39086 1/20 0.31
▸ GRIK2 Q13002 1/20 0.31

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
SCHEMBL28332937 0.97 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL11337785 0.97 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL28351381 0.97 BCL2L1 (0.33) BCL2L1BADTP53TSHRTOP1
SCHEMBL28167830 0.86 MKNK1 (0.35) MKNK1MKNK2ALDH1A1CA12CA1
SCHEMBL28708315 0.84 — —
SCHEMBL23909136 0.84 SETD7 (0.46) TSHRNPC1RAB9AKDM4EALDH1A1
SCHEMBL28504001 0.83 KMO (0.42) NPC1RAB9AKDM4EALDH1A1RXRA
SCHEMBL28044448 0.83 SETD7 (0.47) TSHRNPC1RAB9AKDM4EALDH1A1
SCHEMBL23909137 0.82 SETD7 (0.46) TSHRNPC1RAB9AKDM4EALDH1A1
SCHEMBL23909134 0.82 SETD7 (0.46) TSHRNPC1RAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101702906-B Antibodies and pharmaceutical compositions containing same useful for inhibiting activity of metalloproteins YEDA RES & DEV 2014-02-12 — — CN disclosed
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