SCHEMBL13833017

SCHEMBL13833017

Cc1ccccc1-c1cc(-c2ccccc2)nc(-c2ccccc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 12/20 0.55
KMT2A Q03164 12/20 0.55
MAPT P10636 9/20 0.55
ALDH1A1 P00352 8/20 0.55
HPGD P15428 7/20 0.55
NTSR1 P30989 1/20 0.55
ADORA2A P29274 2/20 0.52
ADORA1 P30542 2/20 0.52
KDM4E B2RXH2 5/20 0.49
POLB P06746 1/20 0.49
PKM P14618 1/20 0.49
RAB9A P51151 1/20 0.49
L3MBTL1 Q9Y468 3/20 0.48
VCP P55072 1/20 0.48
DPP4 P27487 1/20 0.48
CYP2C19 P33261 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
ENPP3 O14638 1/20 0.47
ENPP1 P22413 1/20 0.47

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
SCHEMBL18731948 0.96 MEN1 (0.56) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18731952 0.96 MEN1 (0.56) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20405370 0.91 ENPP3 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18731973 0.90 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20407057 0.89 ENPP3 (0.56) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18731826 0.89 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18731943 0.87 CYP1A1 (0.54) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL18731971 0.87 CYP1A1 (0.54) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL25554392 0.86 MAPT (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL20174193 0.85 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same LG CHEM, LTD. 2021-02-02 US disclosed
US-10738034-B2 Spiro compound and organic light-emitting device comprising same LG CHEM, LTD. (KR) 2020-08-11 US disclosed
EP-3345982-B1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEMICAL LTD (KR) 2020-03-18 EP disclosed
EP-3345982-A1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-11 EP disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
WO-2018016742-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2018-01-25 WO disclosed
EP-3054498-B1 BISIMIDAZODIAZOCINES IDEMITSU KOSAN CO (JP) 2017-09-20 EP disclosed
US-20170244044-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-08-24 US disclosed
US-20170244044-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-08-24 US disclosed
WO-2017061810-A1 DOUBLE SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2017-04-13 WO disclosed
WO-2016125110-A1 BISIMIDAZOLODIAZOCINES IDEMITSU KOSAN CO., LTD. (JP) 2016-08-11 WO disclosed
EP-3054498-A1 Bisimidazodiazocines Idemitsu Kosan Co., Ltd. (JP) 2016-08-10 EP disclosed
WO-2012149999-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-11-08 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 (3 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-10738034-B2 Spiro compound and organic light-emitting device comprising same CRY1, NR2E3, ERG MEN1 611/4885KMT2A 1480/4885MAPT 811/4885
US-10910567-B2 Double spiro-type compound and organic light emitting diode comprising same NR2E3, ALDH1A2, CRY1 MEN1 1825/4885KMT2A 719/4885MAPT 1561/4885
US-20180141933-A1 SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CRY1, NR2E3, ERG MEN1 611/4885KMT2A 1480/4885MAPT 811/4885

“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.