SCHEMBL15895348

SCHEMBL15895348

CC1(C)c2cc3c(cc2-c2cc4c(cc21)-c1c(cc(C#N)c2ccccc12)C4(C)C)C(C)(C)c1cc(C#N)c2ccccc2c1-3

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 3/20 0.36
IMPDH1 P20839 2/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
AR P10275 2/20 0.34
NSD2 O96028 1/20 0.33
ALK Q9UM73 3/20 0.33
TSHR P16473 1/20 0.32
PGR P06401 1/20 0.31
PDK2 Q15119 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
USP8 P40818 1/20 0.30
USP7 Q93009 1/20 0.30
SLC22A12 Q96S37 1/20 0.30

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
SCHEMBL15895318 0.96 PDK2 (0.34) IMPDH2IMPDH1NCOA3ARNSD2
SCHEMBL15895408 0.96 PDK2 (0.34) IMPDH2IMPDH1NCOA3ARNSD2
SCHEMBL15895345 0.92 NSD2 (0.32) IMPDH2IMPDH1NCOA3ARNSD2
SCHEMBL2606511 0.91 PDK2 (0.39) ALKPGRPDK2
SCHEMBL15895347 0.91 SLC22A12 (0.37) IMPDH2IMPDH1NCOA3CA1CA2
SCHEMBL15895349 0.91 ALK (0.33) IMPDH2IMPDH1NCOA3ARNSD2
SCHEMBL15895262 0.91 NCOA3 (0.31) IMPDH2IMPDH1NCOA3
SCHEMBL15895401 0.89 PDK2 (0.33) IMPDH2IMPDH1NCOA3NSD2ALK
SCHEMBL15895402 0.89 PDK2 (0.33) IMPDH2IMPDH1NCOA3NSD2ALK
SCHEMBL15895807 0.89 AR (0.33) IMPDH2IMPDH1NCOA3AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10559756-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2020-02-11 US disclosed
US-20190319194-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2019-10-17 US disclosed
US-20160254456-A1 Materials for Electronic Devices MERCK PATENT GMBH (DE) 2016-09-01 US disclosed
WO-2014111269-A2 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2014-07-24 WO 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-20160254456-A1 Materials for Electronic Devices FHIT, TEC, EED IMPDH2 2270/4885IMPDH1 2997/4885NCOA3 2848/4885
US-10559756-B2 Materials for electronic devices TEC, EFNA1, BMI1 IMPDH2 1985/4885IMPDH1 2015/4885NCOA3 3332/4885

“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.