SCHEMBL7214874

SCHEMBL7214874

Cc1cncc(OCc2ccccc2)c1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.58
MAPT P10636 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
MAPK1 P28482 1/20 0.58
AOC3 Q16853 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.46
STAT3 P40763 1/20 0.46
HTT P42858 1/20 0.46
LIPE Q05469 1/20 0.45
IDO1 P14902 1/20 0.44
MAPK14 Q16539 2/20 0.44
LTA4H P09960 1/20 0.44
BRD4 O60885 3/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
ABCB1 P08183 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42

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
SCHEMBL26985270 0.83 AOC3 (0.55) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL7214872 0.83 AOC3 (0.51) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL12862698 0.79 MAPT (0.53) L3MBTL1MAPTTDP1MAPK1AOC3
Ammonia Solution, Strong SCHEMBL28403781 0.78 MAPT (0.51) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL29248891 0.77 AOC3 (0.49) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL15064968 0.77 AOC3 (0.59) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL2880443 0.77 MAPT (0.81) L3MBTL1MAPTTDP1MAPK1SMN1; SMN2
SCHEMBL10101799 0.76 MAPT (0.47) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL30546852 0.76 CYP11B1 (0.60) L3MBTL1MAPTTDP1MAPK1AOC3
SCHEMBL29248898 0.76 CYP11B1 (0.60) L3MBTL1MAPTTDP1MAPK1AOC3

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
EP-2807171-B1 HETEROCYCLIC COMPOUNDS AND METHODS FOR THEIR USE NOVARTIS AG (CH) 2020-08-12 EP disclosed
US-9624234-B2 Heterocyclic compounds and methods for their use NOVARTIS AG (CH) 2017-04-18 US disclosed
US-9624234-B2 Heterocyclic compounds and methods for their use NOVARTIS AG (CH) 2017-04-18 US disclosed
US-20150218180-A1 Heterocyclic compounds and methods for their use SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2015-08-06 US disclosed
US-20150218180-A1 Heterocyclic compounds and methods for their use SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2015-08-06 US disclosed
US-6503898-B1 Administering 4,7-dibenzyl-5,6-dihydroxy-N,N*-di(m-aminobenzyl)--1,3-diazepin-2-one or salt to treat human immunodeficiency virus infection BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-01-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150218180-A1 Heterocyclic compounds and methods for their use AGTR2, AGTR1, OPRL1 L3MBTL1 4743/4885MAPT 3246/4885TDP1 3672/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.