SCHEMBL2236918

SCHEMBL2236918

CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3c[c]ccc3-c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
HTR2A P28223 2/20 0.38
HSD17B10 Q99714 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SHBG P04278 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
HSPD1 P10809 1/20 0.38
ADRB3 P13945 1/20 0.38
HTR2C P28335 1/20 0.38
HSPE1 P61604 1/20 0.38

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
SCHEMBL5146662 0.88 KDM4E (0.47) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL5148245 0.88 KDM4E (0.47) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL5146765 0.88 KDM4E (0.47) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL2239039 0.83 HSD17B10 (0.41) KDM4ELMNAESR1ADRA2AADORA3
SCHEMBL4453050 0.83 KDM4E (0.46) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL27627804 0.82 KCNH2 (0.42) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL27627944 0.79 HSD17B10 (0.43) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL16502182 0.78 GPR3 (0.44) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL16502179 0.78 GPR3 (0.44) GPR3KDM4ELMNAESR1ADRA2A
SCHEMBL15132545 0.78 GPR3 (0.44) GPR3KDM4ELMNAESR1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110309341-A1 AMINE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME SUMATION CO., LTD. (JP) 2011-12-22 US disclosed
EP-2360201-A1 AMINE POLYMER COMPOUND AND LIGHT-EMITTING ELEMENT USING SAME Sumitomo Chemical Company, Limited (JP) 2011-08-24 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 (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-20110309341-A1 AMINE POLYMER COMPOUND AND LIGHT EMITTING DEVICE USING THE SAME AHR, HRH3, HRH4 GPR3 128/4885KDM4E 1288/4885LMNA 3163/4885

“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.