SCHEMBL21935002

SCHEMBL21935002

Clc1ccc(-c2cccc3c(-c4cccc(-c5ccccc5)c4)nc4ccccc4c23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
MAPK13 O15264 1/20 0.43
GCGR P47871 1/20 0.43
MAPK12 P53778 1/20 0.43
MAPK11 Q15759 1/20 0.43
MAPK14 Q16539 1/20 0.43
DHODH Q02127 3/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C8 P10632 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LTB4R Q15722 1/20 0.40
THRB P10828 1/20 0.40

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
SCHEMBL21935001 0.93 KDM4E (0.58) L3MBTL1KDM4ELMNAGAADHODH
SCHEMBL21933893 0.92 KDM4E (0.60) L3MBTL1KDM4ELMNAGAADHODH
SCHEMBL21934775 0.91 L3MBTL1 (0.49) L3MBTL1KDM4ELMNAGAADHODH
SCHEMBL21934015 0.88 MEN1 (0.48) DHODHCYP1A2ATMADORA2A
SCHEMBL21934842 0.88 MEN1 (0.48) DHODHCYP1A2ATMADORA2A
SCHEMBL21935718 0.87 KDM4E (0.54) L3MBTL1KDM4ELMNAGAADHODH
SCHEMBL21934799 0.85 ACACA (0.43) L3MBTL1KDM4ELMNADHODHMAPK1
SCHEMBL21933713 0.85 MEN1 (0.48) L3MBTL1KDM4ELMNAGAADHODH
SCHEMBL21934302 0.85 MEN1 (0.48) DHODHCYP1A2ATMTP53ADORA2A
SCHEMBL21933687 0.84 MEN1 (0.50) L3MBTL1KDM4ELMNAGAADHODH

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-20200131133-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME HEESUNG MATERIAL LTD. (KR) 2020-04-30 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-20200131133-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 L3MBTL1 1245/4885KDM4E 2576/4885LMNA 3890/4885

“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.