SCHEMBL6980775

SCHEMBL6980775

CCc1ccc(N)cc1NC(=O)c1cccc(CN2CCN(C)CC2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SUCNR1 Q9BXA5 2/20 0.52
CHRM3 P20309 3/20 0.50
HPGDS O60760 1/20 0.48
BTK Q06187 1/20 0.47
WNT1 P04628 1/20 0.47
GSK3B P49841 1/20 0.47
DYRK1A Q13627 1/20 0.47
HDAC1 Q13547 5/20 0.47
HDAC3 O15379 4/20 0.47
HDAC4 P56524 4/20 0.47
HDAC7 Q8WUI4 4/20 0.47
HDAC2 Q92769 4/20 0.47
HDAC10 Q969S8 4/20 0.47
HDAC11 Q96DB2 4/20 0.47
HDAC8 Q9BY41 4/20 0.47
HDAC6 Q9UBN7 4/20 0.47
HDAC9 Q9UKV0 4/20 0.47
HDAC5 Q9UQL6 4/20 0.47
PRMT5 O14744 1/20 0.46
ALDH1A1 P00352 2/20 0.46

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
SCHEMBL4828091 0.88 HPGDS (0.59) SUCNR1CHRM3HPGDSBTKWNT1
SCHEMBL6974580 0.84 WDR5 (0.56) SUCNR1CHRM3ALDH1A1GAA
SCHEMBL31721218 0.79 CHRM3 (0.61) SUCNR1CHRM3BTKWNT1GSK3B
SCHEMBL27551430 0.76 HPGDS (0.57) SUCNR1CHRM3HPGDSBTKHDAC1
SCHEMBL31721288 0.76 HPGDS (0.59) CHRM3HPGDSBTKALDH1A1KDM4E
SCHEMBL31721340 0.75 CHRM3 (0.59) SUCNR1CHRM3BTKHDAC1HDAC3
SCHEMBL6072051 0.74 HDAC6 (0.57) CHRM3BTKHDAC1HDAC3HDAC4
SCHEMBL6782706 0.74 HPGDS (0.75) SUCNR1HPGDSBTKALDH1A1KDM4E
SCHEMBL28394388 0.74 WNT1 (0.53) SUCNR1CHRM3HPGDSBTKWNT1
SCHEMBL27964239 0.74 HDAC6 (0.55) SUCNR1HPGDSBTKHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1146542-C Benzamide derivatives and their use as cytokine inhibitors 2004-04-21 CN disclosed
EP-1115707-B1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2003-11-12 EP disclosed
US-6455520-B1 TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS ASTRA ZENECA AB (SE) 2002-09-24 US disclosed
CN-1319092-A Benzamide derivatives and their use as cytokine inhibitors ASTRAZENECA AB (SE) 2001-10-24 CN disclosed
EP-1115707-A1 BENZAMIDE DERIVATIVES AND THER USE AS CYTOKINE INHIBITORS AstraZeneca AB (SE) 2001-07-18 EP disclosed
WO-2000018738-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS CYTOKINE INHIBITORS ASTRAZENECA AB (SE) 2000-04-06 WO disclosed