SCHEMBL4608900

SCHEMBL4608900

NC(CCC1CO1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SCN4A P35499 7/20 0.39
TDP1 Q9NUW8 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39

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
SCHEMBL3670999 0.81 SCN4A (0.41) SCN4ATDP1CHRM2CHRM4CHRM5
Methane SCHEMBL28528438 0.79 SCN4A (0.40) SCN4ATDP1CHRM2CHRM4CHRM5
SCHEMBL51937 0.78 RIPK1 (0.47) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL2781356 0.75 DPP4 (0.55) SCN4A
SCHEMBL2781359 0.75 DPP4 (0.55) SCN4A
SCHEMBL2784864 0.75 DPP4 (0.55) SCN4A
SCHEMBL7731055 0.73 CYP19A1 (0.50) MEN1KMT2A
SCHEMBL11680802 0.73 IDO1 (0.42) SCN4ACHRM3
SCHEMBL4672036 0.71 HRH1 (0.68) SCN4A
SCHEMBL4672537 0.71 HRH1 (0.68) SCN4A

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-113967258-A FAP-activated therapeutics and uses related thereto 塔夫茨大学信托人 2022-01-25 CN disclosed
CN-113956325-A FAP-activated therapeutics and uses related thereto 塔夫茨大学信托人 2022-01-21 CN disclosed
CN-113786495-A FAP-activated therapeutics and uses related thereto 塔夫茨大学信托人 2021-12-14 CN disclosed
CN-106573073-B FAP-activated therapeutics and uses related thereto 塔夫茨大学信托人 2021-09-28 CN disclosed
EP-1948243-A2 POLYCATION-POLYANION COMPLEXES, COMPOSITIONS AND METHODS OF USE THEREOF Aeris Therapeutics, Inc. (US) 2008-07-30 EP disclosed
WO-2007055950-A2 POLYCATION-POLYANION COMPLEXES, COMPOSITIONS AND METHODS OF USE THEREOF AERIS THERAPEUTICS, INC. (US) 2007-05-18 WO disclosed