SCHEMBL7809191

SCHEMBL7809191

COC(=O)c1ccc(Cc2cc3ccccc3n2Cc2cccnc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.52
KMT2A Q03164 1/20 0.50
DRD2 P14416 5/20 0.49
TBXA2R P21731 5/20 0.49
LMNA P02545 3/20 0.49
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
NAMPT P43490 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL7811881 0.88 LMNA (0.49) TP53KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL7809796 0.87 LMNA (0.52) TP53LMNAHDAC3HDAC4HDAC1
SCHEMBL7811885 0.82 LMNA (0.46) TP53KMT2ALMNAMAPTSMN1; SMN2
SCHEMBL7815558 0.79 LMNA (0.46) TP53KMT2ALMNAHDAC3HDAC4
SCHEMBL30632097 0.77 ALDH1A1 (0.61)
SCHEMBL11059396 0.77 ALDH1A1 (0.61)
SCHEMBL13011169 0.77 CNR2 (0.58) TP53KMT2AHDAC3HDAC2HDAC6
SCHEMBL20634790 0.76 DRD2 (0.51) KMT2ADRD2TBXA2RHDAC1HDAC2
SCHEMBL7809187 0.76 HDAC6 (0.58) LMNAMAPTSMN1; SMN2HDAC3HDAC1
SCHEMBL12472344 0.74 HDAC6 (0.73) TP53KMT2ADRD2TBXA2RMAPT

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
EP-0949259-B1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME NIKKEN CHEMICALS CO LTD (JP) 2001-06-20 EP disclosed
US-6184238-B1 ANTIALLERGENS, ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-02-06 US disclosed
EP-0949259-A1 N-HYDROXYUREA DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Nikken Chemicals Company, Limited (JP) 1999-10-13 EP disclosed