SCHEMBL2155195

SCHEMBL2155195

NC1(N)C=Cc2ccccc2C1c1cccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.43
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP2 O95551 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
HTT P42858 1/20 0.36
GALK1 P51570 1/20 0.36
BLM P54132 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SLC6A4 P31645 5/20 0.36

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
SCHEMBL7999943 0.87 KDM1A (0.39) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL5248281 0.83 KDM1A (0.38) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL11614041 0.83 KDM1A (0.38) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL7775994 0.83 KDM1A (0.38) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL10476854 0.83 KDM1A (0.38) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL4480218 0.80 SLC6A4 (0.36) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL8506986 0.80 SLC6A4 (0.36) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL20597643 0.80 HSD11B1 (0.37) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL14931728 0.80 IDO1 (0.36) KDM1AIDO1ALDH1A1HPGDKDM4E
SCHEMBL391322 0.79 EGFR (0.35) KDM1AIDO1ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108165008-B 1, 1-diacetyl ferrocene chiral poly Schiff base salt/graphene composite wave-absorbing material 南昌航空大学 2020-04-28 CN claimed
JP-3264554-A None JP disclosed
US-10696801-B2 Hydrate inhibitor carrying hydrogel COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2020-06-30 US disclosed
CN-108165008-B 1, 1-diacetyl ferrocene chiral poly Schiff base salt/graphene composite wave-absorbing material 南昌航空大学 2020-04-28 CN disclosed
EP-3357919-B1 AROMATIC HETEROCYCLIC COMPOUNDS AS ANTIINFLAMMATORY COMPOUNDS RESPIVERT LTD (GB) 2019-11-20 EP disclosed
US-20180265647-A1 HYDRATE INHIBITOR CARRYING HYDROGEL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL REASEARCH ORGANISATION (AU) 2018-09-20 US disclosed
EP-3303510-A1 HYDRATE INHIBITOR CARRYING HYDROGEL Commonwealth Scientific and Industrial Research Organisation (AU) 2018-04-11 EP disclosed
WO-2016187672-A1 HYDRATE INHIBITOR CARRYING HYDROGEL COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-12-01 WO disclosed
EP-2521549-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE Otsuka Pharmaceutical Co., Ltd. (JP) 2012-11-14 EP disclosed
WO-2011082337-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORP. (US) 2011-07-07 WO disclosed
JP-H03264554-A PRODUCTION OF 2,2-DIAMINO-1,1-BINAPHTHYL ARAKAWA CHEM IND CO LTD 1991-11-25 JP disclosed