SCHEMBL9234635

SCHEMBL9234635

CC#CCNc1nc2cc(C(=O)O)ccc2o1.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 9/20 0.48
SSTR1 P30872 1/20 0.41
SSTR5 P35346 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MBOAT4 Q96T53 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNH2 Q12809 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
IL6 P05231 1/20 0.39
STAT3 P40763 1/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL9237045 0.99 HDAC6 (0.49) HDAC6SSTR1SSTR5HDAC3HDAC1
SCHEMBL9234640 0.86 HDAC6 (0.45) HDAC6HDAC3HDAC1HDAC8RAB9A
SCHEMBL9230872 0.86 MAPT (0.48) HDAC6HDAC3HDAC1HDAC8NPC1
SCHEMBL7540148 0.74 NPC1 (0.50) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL27756459 0.72 HDAC6 (0.49) HDAC6SSTR1SSTR5HDAC3HDAC1
SCHEMBL31430548 0.72 HDAC6 (0.62) HDAC6HDAC3HDAC1HDAC8NPC1
SCHEMBL2841557 0.72 TTR (0.49) HDAC6SSTR5NPC1RAB9AHPGD
SCHEMBL5364592 0.71 THRB (0.57) HDAC6HDAC1MBOAT4KCNH2MEN1
SCHEMBL31430456 0.71 HDAC6 (0.54) HDAC6HDAC3HDAC1HDAC8KCNH2
SCHEMBL21066322 0.71 HDAC6 (0.52) HDAC6HDAC3HDAC1HDAC8NPC1

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
EP-0665461-A1 Photographic sensitivity increasing alkynylamine compounds and photographic elements EASTMAN KODAK COMPANY (US) 1995-08-02 EP disclosed
US-5413905-A High speed EASTMAN KODAK COMPANY (US) 1995-05-09 US disclosed