SCHEMBL10399486

SCHEMBL10399486

CC(=O)N(CCc1ccc(Br)cc1)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
HDAC1 Q13547 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
FOLH1 Q04609 1/20 0.48
MAPT P10636 2/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LPAR1 Q92633 1/20 0.47
LPAR5 Q9H1C0 1/20 0.47
LMNA P02545 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CA12 O43570 5/20 0.46
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA4 P22748 3/20 0.46
TAAR1 Q96RJ0 1/20 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
SCHEMBL2186353 0.91 RCE1 (0.56) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL1901574 0.89 RCE1 (0.52) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL4467147 0.89 RCE1 (0.52) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL10398283 0.86 RCE1 (0.53) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL6901088 0.86 RCE1 (0.53) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL10399412 0.85 LMNA (0.56) RCE1MEN1KMT2AMAPTNPC1
SCHEMBL14544524 0.82 LPAR1 (0.67) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL28107769 0.82 MEN1 (0.61) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL13708399 0.81 HDAC1 (0.52) RCE1MEN1KMT2AHDAC1HDAC6
SCHEMBL12449247 0.80 FOLH1 (0.48) MEN1KMT2AHDAC1HDAC6FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4977144-A ADENOSINE AGONISTS CIBA-GEIGY CORPORATION (US) 1990-12-11 US disclosed
EP-0354180-A2 Certain imidazo[4,5-b]pyridine derivatives CIBA-GEIGY AG (CH) 1990-02-07 EP disclosed