SCHEMBL11529919

SCHEMBL11529919

CC1(C)C=NN=C(c2ccc(Cl)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
RECQL P46063 2/20 0.35
NOTUM Q6P988 1/20 0.35
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
PKM P14618 2/20 0.35
ALPL P05186 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
KDM4E B2RXH2 3/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL11528430 0.66 NOTUM (0.39) MEN1KMT2AL3MBTL1RECQLNOTUM
SCHEMBL11531245 0.64 ALDH1A1 (0.38) MEN1KMT2ANOTUMSMN1; SMN2NPC1
SCHEMBL4339852 0.63 PTGS1 (0.43) MEN1KMT2AL3MBTL1RECQLPTGS1
SCHEMBL14278603 0.63 RECQL (0.49) MEN1KMT2AL3MBTL1RECQLNOTUM
SCHEMBL8302897 0.62 NOTUM (0.47) MEN1KMT2AL3MBTL1NOTUMSMN1; SMN2
SCHEMBL11568277 0.61 HRH3 (0.50) MEN1KMT2AL3MBTL1RECQLNOTUM
SCHEMBL3983896 0.60 RECQL (0.46) MEN1KMT2AL3MBTL1RECQLNOTUM
SCHEMBL11867988 0.59 RECQL (0.46) RECQLNOTUMPTGS1PTGS2NPC1
SCHEMBL11826349 0.58 RECQL (0.44) MEN1KMT2AL3MBTL1RECQLNOTUM
SCHEMBL30236261 0.58 RECQL (0.53) RECQLALPLSMN1; SMN2NPC1RAB9A

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-4136184-A TRANQUILIZERS, ANTICONVULSANTS, MUSCLE RELAXANTS SANDOZ, INC. (US) 1979-01-23 US disclosed
US-4055644-A CNS DEPRESSANTS SANDOZ, INC. (US) 1977-10-25 US disclosed
US-3931176-A CNS DEPRESSANT SANDOZ INC. (US) 1976-01-06 US disclosed