SCHEMBL23517748

SCHEMBL23517748

c1ccc(-c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cc(-c5ccccc5)c5c(c4)sc4ccccc45)n3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 1/20 0.35
▸ PI4KA P42356 1/20 0.35
▸ PI4KB Q9UBF8 1/20 0.35
▸ F9 P00740 1/20 0.35
▸ MAP3K8 P41279 3/20 0.34
▸ GPR3 P46089 1/20 0.34
▸ GP6 Q9HCN6 1/20 0.34
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ CHEK1 O14757 1/20 0.33
▸ WEE1 P30291 1/20 0.33
▸ PIM3 Q86V86 1/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ SLC9A1 P19634 1/20 0.32
▸ NR1I3 Q14994 1/20 0.32

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
SCHEMBL23517745 0.99 ADORA2A (0.35) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23312487 0.97 PIK3CA (0.37) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL25645756 0.95 PIK3CA (0.37) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23312375 0.95 MAP3K8 (0.37) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23517781 0.95 MAP3K8 (0.37) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23517675 0.93 PIK3CA (0.38) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23517530 0.93 ADORA2A (0.35) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23517753 0.93 ADORA2A (0.35) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23312649 0.93 MAP3K8 (0.36) PIK3CAPI4KAPI4KBF9MAP3K8
SCHEMBL23517740 0.93 ADORA2A (0.37) F9MAP3K8GPR3ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018022-B2 Heterocyclic compound, organic light emitting diode comprising same, composition for organic layer of organic light emitting diode, and method for manufacturing organic light emitting diode LT MATERIALS CO., LTD. (KR) 2024-06-25 — — US disclosed
US-12018022-B2 Heterocyclic compound, organic light emitting diode comprising same, composition for organic layer of organic light emitting diode, and method for manufacturing organic light emitting diode LT MATERIALS CO., LTD. (KR) 2024-06-25 — — US disclosed
US-20210179596-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE LT MATERIALS CO., LTD. (KR) 2021-06-17 — — 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 (2 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-12018022-B2 Heterocyclic compound, organic light emitting diode comprising same, composition for organic layer of organic light emitting diode, and method for manufacturing organic light emitting diode ODC1, AOX1, CYP1B1 PIK3CA 3981/4885PI4KA 4106/4885PI4KB 4319/4885
US-20210179596-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DIODE COMPRISING SAME, COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DIODE, AND METHOD FOR MANUFACTURING ORGANIC LIGHT EMITTING DIODE ODC1, AOX1, CYP1B1 PIK3CA 3981/4885PI4KA 4106/4885PI4KB 4319/4885

“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.

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