SCHEMBL19082503

SCHEMBL19082503

CC(C)(O)c1ccc(Br)cc1-c1ccc2c(c1)sc1ccc3ccccc3c12

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNJ11 Q14654 2/20 0.31
F9 P00740 2/20 0.30
MCL1 Q07820 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
SCHEMBL18803777 0.78 CYP1A1 (0.39) F9MCL1
SCHEMBL17275796 0.78 CYP2A6 (0.42)
SCHEMBL17382909 0.78 CYP2A6 (0.39) F9
SCHEMBL17852129 0.77 CYP2A6 (0.47)
SCHEMBL19082510 0.76 KDM4E (0.40) MCL1
SCHEMBL17382968 0.75 MCL1 (0.37) F9MCL1
SCHEMBL19082479 0.75 CYP1A1 (0.38) MCL1
SCHEMBL17836992 0.72 KCNJ11 (0.38) KCNJ11
SCHEMBL20407103 0.72 TSHR (0.40) MCL1
SCHEMBL10122713 0.71 NQO2 (0.41) MCL1

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-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 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-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 KCNJ11 2284/4885F9 1203/4885MCL1 1139/4885

“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.