SCHEMBL17827258

SCHEMBL17827258

C[C@@H]1[C@H](C)[C@H](C)N(Cc2ccccc2)[C@@H]1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.47
CHRM4 P08173 1/20 0.47
CHRM5 P08912 1/20 0.47
ACHE P22303 1/20 0.47
ELANE P08246 2/20 0.44
SIGMAR1 Q99720 1/20 0.43
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
CTRC Q99895 1/20 0.41
MC4R P32245 1/20 0.41
MAPT P10636 1/20 0.41
CYP19A1 P11511 1/20 0.40
ABCB1 P08183 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL12855709 0.91 CHRM2 (0.50) CHRM2CHRM4CHRM5ACHEELANE
SCHEMBL15593280 0.83 FUCA1 (0.48) CHRM2CHRM4CHRM5ACHEELANE
SCHEMBL13889204 0.81 CHRM2 (0.50) CHRM2CHRM4CHRM5ACHEELANE
SCHEMBL5745796 0.80 MAPT (0.47) CHRM2CHRM4CHRM5ACHEELANE
SCHEMBL11144165 0.76 ACHE (0.55) CHRM2CHRM4CHRM5ACHESIGMAR1
SCHEMBL10077401 0.76 ACHE (0.55) CHRM2CHRM4CHRM5ACHESIGMAR1
SCHEMBL20797832 0.76 CHRM2 (0.55) CHRM2CHRM4CHRM5ACHESIGMAR1
SCHEMBL20811168 0.76 CHRM2 (0.55) CHRM2CHRM4CHRM5ACHESIGMAR1
SCHEMBL16800326 0.75 CHRM2 (0.54) CHRM2CHRM4CHRM5ACHEELANE
SCHEMBL5492314 0.75 CHRM2 (0.54) CHRM2CHRM4CHRM5ACHEELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9991454-B2 Organometallic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-05 US disclosed
US-20170033301-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-02 US disclosed
US-20160172607-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) 2016-06-16 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-20160172607-A1 ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME LEF1, OCIAD1, OXA1L CHRM2 641/4885CHRM4 657/4885CHRM5 1416/4885

“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.