SCHEMBL18845829

SCHEMBL18845829

CC1(C)c2ccccc2-c2c1ccc1c(-c3ccc(-c4nc(-c5ccccc5)nc5ccccc45)cc3)nc3ccccc3c21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ATM Q13315 2/20 0.48
WHR1 P49842 1/20 0.38
NUDT1 P36639 3/20 0.36
ADORA2A P29274 2/20 0.35
NPC1 O15118 1/20 0.35
XBP1 P17861 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
ACP1 P24666 3/20 0.34
MAPT P10636 3/20 0.34
CYP1A2 P05177 2/20 0.34
PDE5A O76074 1/20 0.34
RAD52 P43351 1/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34

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
SCHEMBL18845731 0.99 ATM (0.47) MEN1KMT2AATMWHR1NUDT1
SCHEMBL18845710 0.95 ATM (0.44) MEN1KMT2AATMWHR1NUDT1
SCHEMBL18845967 0.93 MEN1 (0.41) MEN1KMT2AATMWHR1NUDT1
SCHEMBL18845735 0.91 MEN1 (0.38) MEN1KMT2AATMWHR1NUDT1
SCHEMBL18845806 0.91 MEN1 (0.38) MEN1KMT2AATMWHR1NUDT1
SCHEMBL18845712 0.90 MEN1 (0.38) MEN1KMT2AATMWHR1NPSR1
SCHEMBL18845930 0.90 MEN1 (0.38) MEN1KMT2AATMWHR1NPSR1
SCHEMBL18845877 0.90 MEN1 (0.38) MEN1KMT2AATMWHR1NPSR1
SCHEMBL18845871 0.88 MEN1 (0.36) MEN1KMT2AATMWHR1ADORA2A
SCHEMBL19315741 0.87 MEN1 (0.48) MEN1KMT2AATMWHR1NUDT1

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-10446765-B2 Heterocyclic compound and organic light emitting element using same HEESUNG MATERIAL LTD. (KR) 2019-10-15 US disclosed
US-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-11 US disclosed
US-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME HEESUNG MATERIAL LTD. (KR) 2017-05-11 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-20170133602-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME CRY1, CRY2, PER2 MEN1 1034/4885KMT2A 579/4885ATM 3417/4885
US-10446765-B2 Heterocyclic compound and organic light emitting element using same CRY1, CRY2, PER2 MEN1 1034/4885KMT2A 579/4885ATM 3417/4885

“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.