SCHEMBL28306356

SCHEMBL28306356

COc1ccc(CN2C=C(c3cc(C(F)F)nc(S(=O)(=O)CCC(OCc4ccccc4)c4ccccc4)n3)C=CC2)cc1OC

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 9/20 0.35
▸ PDE2A O00408 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ KMT2A Q03164 4/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TP53 P04637 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL28306419 0.90 SDHB (0.46) SDHBKMT2AHSD17B10TP53LMNA
SCHEMBL28307450 0.87 SDHB (0.39) SDHBPDE2APDE3AKMT2AMEN1
SCHEMBL28910510 0.87 TP53 (0.39) SDHBKMT2AMEN1TP53MAPT
SCHEMBL28307468 0.85 PDE2A (0.32) PDE2APDE3AKMT2ANPC1RAB9A
SCHEMBL28307456 0.82 SDHB (0.43) SDHBPDE2APDE3AKMT2AMEN1
SCHEMBL20985617 0.80 SDHB (0.58) SDHB
SCHEMBL28307435 0.77 SDHB (0.33) SDHBPDE2APDE3AKMT2AMAPK1
SCHEMBL28306288 0.75 — —
SCHEMBL28910522 0.73 KDM4E (0.34) KMT2AMEN1HSD17B10MAPTLMNA
SCHEMBL28306298 0.73 SDHB (0.50) SDHBKMT2ARAB9AMAPK1HSD17B10

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-110023292-A Apoptosis inhibitor 北京生命科学研究所 2019-07-16 — — CN disclosed
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