SCHEMBL17404398

SCHEMBL17404398

Cc1c2c3c(cccc3c3cc(Cl)ccc13)C(C)(C)c1cc(Cl)ccc1-2

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.32
AKR1A1 P14550 1/20 0.32
AKR1B1 P15121 1/20 0.32
PGR P06401 4/20 0.31
PDK2 Q15119 1/20 0.31
NR3C1 P04150 1/20 0.31
CYP11B1 P15538 1/20 0.30
CYP11B2 P19099 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
SCHEMBL17404400 0.86 AKR1A1 (0.31) AKR1A1AKR1B1PDK2CYP11B1CYP11B2
SCHEMBL17404402 0.85 DPP4 (0.37) AKR1A1AKR1B1PDK2
SCHEMBL806787 0.80 AHR (0.34) PGR
SCHEMBL17404205 0.77 PDK2 (0.30) PDK2
SCHEMBL17404397 0.76 AKR1A1 (0.38) CRHR1AKR1A1AKR1B1PGRPDK2
SCHEMBL17404224 0.74
SCHEMBL17404210 0.74
SCHEMBL17404146 0.74 PDK2 (0.33) PDK2
SCHEMBL31363013 0.74 PDK2 (0.43) CRHR1AKR1A1AKR1B1PGRPDK2
SCHEMBL17404208 0.73

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-9793500-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-10-17 US disclosed
US-9793500-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-10-17 US disclosed
US-20160005984-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-07 US disclosed
US-20160005984-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-01-07 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-20160005984-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CCNT1, CCNE2, CCNE1 CRHR1 199/4885AKR1A1 1387/4885AKR1B1 1604/4885

“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.