SCHEMBL17852149

SCHEMBL17852149

CCOC(=O)c1ccc(Br)cc1-c1ccc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.52
SLC6A4 P31645 2/20 0.52
SLC6A3 Q01959 2/20 0.52
JAK2 O60674 1/20 0.48
JAK3 P52333 1/20 0.48
TSHR P16473 1/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CCNC P24863 1/20 0.45
CDK8 P49336 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
KDM4E B2RXH2 2/20 0.44
GLA P06280 2/20 0.44
GAA P10253 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL13776780 0.88 SLC6A3 (0.57) SLC6A2SLC6A4SLC6A3JAK2JAK3
SCHEMBL8158480 0.82 CA12 (0.57) TSHRALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL19082480 0.81 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL19082510 0.80 KDM4E (0.40) ALDH1A1SMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL9181819 0.80 TUBB4A (0.55) ALDH1A1SMN1; SMN2NPC1KDM4EGAA
SCHEMBL15505862 0.80 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3JAK2JAK3
SCHEMBL17852148 0.80 ALDH1A1 (0.49) TSHRALDH1A1SMN1; SMN2RAB9AKDM4E
SCHEMBL17836985 0.80 CDC25B (0.54) TSHRALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL20806379 0.78 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3JAK2JAK3
SCHEMBL17852141 0.77 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3JAK2JAK3

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-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 US disclosed
US-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-23 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-20160181542-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME L1CAM, H1-10, H1-0 SLC6A2 4029/4885SLC6A4 4313/4885SLC6A3 4608/4885

“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.