SCHEMBL22015130

SCHEMBL22015130

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5nc(-c6ccccc6)c6cc7c(cc6c5c4)C4(c5ccccc5S7)c5ccccc5-c5ccccc54)n3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
WHR1 P49842 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 1/20 0.34
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL22015165 0.99 WHR1 (0.36) WHR1MEN1KMT2AATMKDM4E
SCHEMBL22015147 0.98 MEN1 (0.34) WHR1MEN1KMT2AATMKDM4E
SCHEMBL24182822 0.98 MEN1 (0.34) WHR1MEN1KMT2AATMKDM4E
SCHEMBL22015133 0.97 WHR1 (0.33) WHR1MEN1KMT2AATM
SCHEMBL22015168 0.96 WHR1 (0.34) WHR1MEN1KMT2AATM
SCHEMBL22017828 0.94 KMT2A (0.37) WHR1MEN1KMT2AATMKDM4E
SCHEMBL22015131 0.93 MEN1 (0.33) WHR1MEN1KMT2AATMKDM4E
SCHEMBL22015134 0.93 MEN1 (0.33) WHR1MEN1KMT2AATMKDM4E
SCHEMBL24182814 0.93 MEN1 (0.33) WHR1MEN1KMT2AATMKDM4E
SCHEMBL24182736 0.93 WHR1 (0.37) WHR1MEN1KMT2AATM

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-20220013729-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2022-01-13 US disclosed
WO-2020101314-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 엘티소재주식회사 2020-05-22 WO 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-20220013729-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME CRY1, CYP1B1, CYP1A1 WHR1 475/4885MEN1 700/4885KMT2A 656/4885

“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.