SCHEMBL11322744

SCHEMBL11322744

O=C(NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 6/20 1.00
▸ KDM4E B2RXH2 6/20 1.00
▸ KMT2A Q03164 6/20 0.83
▸ MEN1 O00255 5/20 0.83
▸ TDP1 Q9NUW8 4/20 0.83
▸ CTDSP1 Q9GZU7 2/20 0.83
▸ NPC1 O15118 3/20 0.78
▸ RAB9A P51151 3/20 0.78
▸ PTPN1 P18031 3/20 0.75
▸ HTT P42858 1/20 0.73
▸ CACNA1B Q00975 1/20 0.72
▸ APBA1 Q02410 1/20 0.72
▸ SIRT1 Q96EB6 1/20 0.71
▸ FFAR1 O14842 1/20 0.70
▸ MAPT P10636 2/20 0.69
▸ SMN1; SMN2 Q16637 1/20 0.69
▸ LMNA P02545 3/20 0.69
▸ DUSP3 P51452 1/20 0.69
▸ PTPN5 P54829 1/20 0.69
▸ PTPN11 Q06124 1/20 0.69

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
SCHEMBL18103163 0.94 NPC1 (0.88) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL14715824 0.94 NPC1 (0.88) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL26953087 0.91 PTPN1 (0.88) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL126415 0.91 PTPN1 (0.87) POLBKDM4EKMT2AMEN1NPC1
SCHEMBL11688443 0.90 DEGS1 (0.83) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL14715847 0.89 PTPN1 (0.84) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL5344166 0.88 NPC1 (1.00) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL8768933 0.88 NPC1 (1.00) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL31432724 0.88 NPC1 (1.00) POLBKDM4EKMT2AMEN1TDP1
SCHEMBL679222 0.88 DEGS1 (0.79) POLBKDM4EKMT2AMEN1TDP1

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-4306930-A INCORPORATING A HYDRAZIDE OR DIHYDRAZIDE AND THEN VULCANIZING IN CONTACT WITH A METAL CIBA-GEIGY CORPORATION (US) 1981-12-22 — — US disclosed
US-4077948-A N-SALICYLIDENE-N*-SALICYLHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1978-03-07 — — US disclosed
US-3994987-A Metal deactivators as adhesion promotors for vulcanizable elastomers to metals CIBA-GEIGY CORPORATION (US) 1976-11-30 — — US disclosed
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