SCHEMBL19486201

SCHEMBL19486201

C/C(=N\c1ccccc1C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.52
ESR1 P03372 1/20 0.52
SIGMAR1 Q99720 6/20 0.50
GRIN2D O15399 3/20 0.44
GRIN3B O60391 3/20 0.44
GRIN1 Q05586 3/20 0.44
GRIN2A Q12879 3/20 0.44
GRIN2B Q13224 3/20 0.44
GRIN2C Q14957 3/20 0.44
GRIN3A Q8TCU5 3/20 0.44
MEN1 O00255 1/20 0.44
PABPC1 P11940 1/20 0.44
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
EBP Q15125 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
LMNA P02545 2/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL24250350 0.85 ESR2 (0.50) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL15082912 0.82 ESR2 (0.44) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL24791115 0.82 ESR2 (0.47) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL21251193 0.81 MAPT (0.54) MEN1ALOX15TSHRKMT2ALMNA
SCHEMBL15275530 0.81 ESR2 (0.75) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL31173668 0.81 MEN1 (0.51) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL24285333 0.79 ESR2 (0.45) ESR2ESR1SIGMAR1GRIN2DGRIN3B
SCHEMBL1071468 0.79 GRIN2D (0.44) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1071463 0.79 GRIN2D (0.44) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL20860406 0.79 SIGMAR1 (0.55) ESR2ESR1SIGMAR1GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023123673-A1 NON-AQUEOUS ELECTROLYTE AND LITHIUM-ION BATTERY COMPRISING NON-AQUEOUS ELECTROLYTE 张家港市国泰华荣化工新材料有限公司 2023-07-06 WO disclosed
US-20220123225-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2022-04-21 US disclosed
EP-3172775-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-04-20 EP disclosed
US-20220013729-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2022-01-13 US disclosed
EP-1718121-B1 ORGANIC ELECTROLUMINESCENT DEVICE IDEMITSU KOSAN CO (JP) 2020-11-25 EP disclosed
WO-2020101314-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 엘티소재주식회사 2020-05-22 WO disclosed
WO-2020101316-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 엘티소재주식회사 2020-05-22 WO disclosed
WO-2017178864-A1 SEVEN-MEMBERED RING COMPOUNDS IDEMITSU KOSAN CO., LTD. (JP) 2017-10-19 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 (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-20220123225-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME CRY1, CYP1A1, CYP1B1 ESR2 706/4885ESR1 112/4885SIGMAR1 1808/4885
US-20220013729-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME CRY1, CYP1B1, CYP1A1 ESR2 537/4885ESR1 95/4885SIGMAR1 1040/4885

“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.