SCHEMBL18201002

SCHEMBL18201002

c1ccc(-c2cccc(-c3nc(-c4ccc(-c5cc6c(-c7ccc8ccccc8c7)nc7ccccc7c6c6ccccc56)cc4)nc4ccccc34)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.46
ADORA2A P29274 3/20 0.36
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
CYP1A2 P05177 3/20 0.36
ABCG2 Q9UNQ0 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
WHR1 P49842 1/20 0.36
ACACA Q13085 1/20 0.36
MAPT P10636 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
USP2 O75604 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL18346988 1.00 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200784 1.00 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200797 1.00 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200963 0.98 MEN1 (0.43) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200966 0.98 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200912 0.98 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200960 0.98 MEN1 (0.46) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18346989 0.98 MEN1 (0.43) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200786 0.98 MEN1 (0.43) MEN1KMT2AATMADORA2AAURKA
SCHEMBL18200911 0.97 MEN1 (0.48) MEN1KMT2AATMADORA2AAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9728731-B2 Heterocyclic compound and organic light emitting device using same HEESUNG MATERIAL LTD. (KR) 2017-08-08 US disclosed
US-9728731-B2 Heterocyclic compound and organic light emitting device using same HEESUNG MATERIAL LTD. (KR) 2017-08-08 US disclosed
US-20160380208-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME HEESUNG MATERIAL LTD. (KR) 2016-12-29 US disclosed
EP-3088392-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME Heesung Material Ltd. (KR) 2016-11-02 EP 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-20160380208-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME NOTUM, DDT, CRY1 MEN1 1750/4885KMT2A 1104/4885ATM 2923/4885

“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.