SCHEMBL20560780

SCHEMBL20560780

Clc1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4sc5ccccc5c4c3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
PDE5A O76074 2/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
GPR3 P46089 1/20 0.41
NR1H2 P55055 2/20 0.41
NR1H3 Q13133 2/20 0.41
ATM Q13315 1/20 0.41
EGFR P00533 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
CYP1A2 P05177 2/20 0.40
DPP4 P27487 1/20 0.40
CTRC Q99895 1/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 2/20 0.39

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
SCHEMBL23686640 0.92 GPR3 (0.48) KDM4EGPR3ATMRAB9ACYP1A2
SCHEMBL15501884 0.92 GPR3 (0.48) KDM4EGPR3ATMRAB9ACYP1A2
SCHEMBL20561300 0.91 GPR3 (0.41) KDM4EGPR3ATMNPC1RAB9A
SCHEMBL22025225 0.91 PDE5A (0.43) KDM4EPDE5AABCG2GPR3NR1H2
SCHEMBL19802291 0.91 HTT (0.49) KDM4EPDE5AABCG2NR1H2NR1H3
SCHEMBL25645941 0.91 GPR3 (0.47) KDM4EGPR3ATMRAB9ACYP1A2
SCHEMBL24808288 0.90 GPR3 (0.40) KDM4EGPR3ATMRAB9AHTT
SCHEMBL18212422 0.89 GPR3 (0.45) KDM4EGPR3ATMRAB9AMAPK1
SCHEMBL22329662 0.88 MAPT (0.45) KDM4EGPR3ATMRAB9ACYP1A2
SCHEMBL25000309 0.88 GPR3 (0.44) KDM4EGPR3ATMRAB9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12167689-B2 Heterocyclic compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2024-12-10 US disclosed
US-11903311-B2 Heterocyclic compound and organic light emitting device comprising the same LG CHEM, LTD. (KR) 2024-02-13 US disclosed
US-20220336757-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2022-10-20 US disclosed
EP-3480194-B1 HETEROCYCLIC COMPOUNDS AND ORGANIC LIGHT-EMITTING DEVICES USING SAME LG CHEMICAL LTD (KR) 2021-09-08 EP disclosed
EP-3480194-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME LG Chem, Ltd. (KR) 2019-05-08 EP disclosed
US-20180337348-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2018-11-22 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 (4 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-11903311-B2 Heterocyclic compound and organic light emitting device comprising the same CYP1A1, CYP1B1, CHRM1 KDM4E 3276/4885PDE5A 4561/4885ABCG2 3127/4885
US-20180337348-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CRY2, ORC3 KDM4E 2030/4885PDE5A 3972/4885ABCG2 2246/4885
US-12167689-B2 Heterocyclic compound and organic light emitting device comprising the same C1S, ARRB1, CRY1 KDM4E 3830/4885PDE5A 4562/4885ABCG2 3605/4885
US-20220336757-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME C1S, CNR1, ARRB1 KDM4E 3734/4885PDE5A 4539/4885ABCG2 3218/4885

“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.