SCHEMBL19082485

SCHEMBL19082485

Oc1c(-c2cc(Br)ccc2F)ccc(-c2cc3ccccc3cc2F)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NMUR2 Q9GZQ4 3/20 0.45
CYP2A6 P11509 1/20 0.41
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
PTPRC P08575 1/20 0.36
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35
BCL2 P10415 1/20 0.35
MCL1 Q07820 1/20 0.35
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
AMY1A P0DUB6 1/20 0.34
NPC1 O15118 1/20 0.34
HTT P42858 1/20 0.34
PDK2 Q15119 1/20 0.33

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
SCHEMBL19077660 0.86 CYP2A6 (0.42) NMUR2CYP2A6MEN1MAPTHPGD
SCHEMBL9108932 0.85 NMUR2 (0.48) NMUR2MEN1MAPTHPGDKMT2A
SCHEMBL16067923 0.85 CYP2A6 (0.45) NMUR2CYP2A6MEN1MAPTHPGD
SCHEMBL16067918 0.83 NMUR2 (0.50) NMUR2CYP2A6MEN1MAPTHPGD
SCHEMBL19082471 0.81 NMUR2 (0.46) NMUR2CYP2A6MEN1MAPTHPGD
SCHEMBL19091476 0.80 NPC1 (0.42) NMUR2CYP2A6PTPRCTP53THRB
SCHEMBL9110357 0.78 CYP2A6 (0.45) NMUR2CYP2A6MEN1MAPTHPGD
SCHEMBL19110429 0.77 NMUR2 (0.42) NMUR2MEN1MAPTHPGDKMT2A
SCHEMBL19082487 0.76 NPC1 (0.39) NMUR2CYP2A6PTPRCTP53THRB
SCHEMBL17683933 0.75 MBNL1 (0.41) NMUR2CYP2A6MEN1MAPTHPGD

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 NMUR2 2800/4885CYP2A6 2198/4885MEN1 277/4885

“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.