SCHEMBL5984776

SCHEMBL5984776

CCn1c(=O)cc(C)c2cc(C)ccc21

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.64
POLB P06746 1/20 0.64
HSD17B10 Q99714 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
PGR P06401 1/20 0.46
RORA P35398 1/20 0.46
RORC P51449 1/20 0.46
RORB Q92753 1/20 0.46
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
MAPT P10636 4/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 2/20 0.41
LMNA P02545 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
SCHEMBL21476669 0.83 KDM4E (0.47) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL17505195 0.83 KDM4E (0.55) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL3781733 0.83 KDM4E (0.47) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL11999969 0.82 KDM4E (0.59) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL30367071 0.81 MEN1 (0.69) KDM4EHSD17B10KMT2AMEN1PGR
SCHEMBL17066941 0.81 MEN1 (0.69) KDM4EHSD17B10KMT2AMEN1PGR
SCHEMBL30379290 0.80 KDM4E (0.49) KDM4EPOLBHSD17B10L3MBTL1KMT2A
Hydrochloric Acid SCHEMBL30380270 0.80 MEN1 (0.44) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL26091169 0.80 KDM4E (0.49) KDM4EPOLBHSD17B10L3MBTL1KMT2A
SCHEMBL1611235 0.79 KDM4E (0.52) KDM4EPOLBHSD17B10L3MBTL1KMT2A

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
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-8389511-B2 Bicyclic heterocyclic derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-03-05 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US disclosed
EP-2447264-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-05-02 EP disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
US-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE DAINIPPON SUMITOMO PHARMA CO. 2011-08-04 US disclosed
WO-2010150840-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE 大日本住友製薬株式会社 (JP) 2010-12-29 WO disclosed
EP-2243779-A1 BICYCLIC HETEROCYCLIC DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2010-10-27 EP 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-20110190278-A1 BICYCLIC HETEROCYCLIC DERIVATIVE REN, AGTR1, AGTR2 KDM4E 2766/4885POLB 805/4885HSD17B10 566/4885
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE REN, AGTR1, AGTR2 KDM4E 2147/4885POLB 947/4885HSD17B10 976/4885

“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.