SCHEMBL22925293

SCHEMBL22925293

Clc1cccc2c1sc1c3ccccc3c(N(c3ccccc3)c3ccccc3)cc21

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.32
CYP2A6 P11509 2/20 0.32
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
MAPT P10636 1/20 0.31
THRB P10828 1/20 0.31
PFKFB4 Q16877 1/20 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
SCHEMBL15852806 0.89 ALDH1A1 (0.33) CYP1A2ALDH1A1TDP1MAPT
SCHEMBL22891585 0.86 CYP1A2 (0.34) CYP1A2CYP2A6ALDH1A1TDP1MCL1
SCHEMBL22925354 0.83 MCL1 (0.35) ALDH1A1MAPTMCL1
SCHEMBL15852811 0.82 CYP1A1 (0.33) CYP1A1CYP1B1MAPT
SCHEMBL15852818 0.81 APP (0.34) CYP1A2ALDH1A1TDP1CYP1A1CYP1B1
SCHEMBL15852803 0.81 MAPT (0.39) ALDH1A1TDP1MAPTTHRB
SCHEMBL23975343 0.80 KDM4E (0.32) CYP1A2ALDH1A1TDP1MAPT
SCHEMBL15852807 0.80 CYP2C19 (0.34) CYP1A2ALDH1A1TDP1MAPTTHRB
SCHEMBL15852508 0.80 GPR3 (0.42) CYP1A2ALDH1A1MAPT
SCHEMBL15852808 0.79 ALDH1A1 (0.33) CYP1A2ALDH1A1TDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210028370-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREFOR DUK SAN NEOLUX CO., LTD. (KR) 2021-01-28 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-20210028370-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING THE SAME, AND ELECTRONIC DEVICE THEREFOR OR51E2, WEE1, SLC39A11 CYP1A2 4244/4885CYP2A6 3155/4885ALDH1A1 1905/4885

“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.