SCHEMBL4870334

SCHEMBL4870334

c1ccc2c(c1)c1ccccc1n2-c1nccs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.49
MAPT P10636 6/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
G6PD P11413 1/20 0.49
PKM P14618 1/20 0.49
MPI P34949 1/20 0.49
EP300 Q09472 1/20 0.49
KAT2A Q92830 1/20 0.49
KAT2B Q92831 1/20 0.49
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.46
NPSR1 Q6W5P4 3/20 0.46
HPGD P15428 1/20 0.46
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 2/20 0.40
LMNA P02545 1/20 0.40
GLA P06280 1/20 0.40

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
SCHEMBL28222052 0.86 KDM4E (0.43) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL31205780 0.80 KDM4E (0.46) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL4172313 0.75 CDK5 (0.50) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL10981062 0.73 MAPK1 (0.54) KDM4EMAPTALDH1A1KMT2AMEN1
SCHEMBL11097221 0.73 CSNK1A1 (0.61) KDM4EALDH1A1KMT2AMEN1NPSR1
SCHEMBL216173 0.73 CYP17A1 (0.42) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL10659563 0.73 KDM4E (0.40) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL14894230 0.72 HPGD (0.42) KDM4EMAPTALDH1A1GAATDP1
SCHEMBL19382268 0.71 KDM4E (0.48) KDM4EMAPTALDH1A1ATML3MBTL1
SCHEMBL15052361 0.71 PDPK1 (0.41) KDM4EMAPTALDH1A1GAATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106366069-B A kind of preparation method of N- heteroaryl carbazole compound 浙江工业大学 2019-01-08 CN disclosed
CN-106366069-A Preparation method of N-heteroaryl carbazole compounds 浙江工业大学 2017-02-01 CN disclosed
CN-1609101-B Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LAB 2010-05-26 CN disclosed
US-7314769-B2 Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-01-01 US disclosed
US-6998492-B2 Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-02-14 US disclosed
CN-1609101-A Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LAB (JP) 2005-04-27 CN disclosed
US-20050033054-A1 Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2005-02-10 US disclosed
US-20040230061-A1 Organometallic complex and light-emitting element containing the same SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2004-11-18 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 (2 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-20050033054-A1 Organometallic complex and light-emitting element containing the same BCKDK, CCNK, CDK20 KDM4E 463/4885MAPT 4092/4885ALDH1A1 355/4885
US-20040230061-A1 Organometallic complex and light-emitting element containing the same NR0B1, BCKDK, NR4A1 KDM4E 384/4885MAPT 3920/4885ALDH1A1 256/4885

“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.