SCHEMBL18713340

SCHEMBL18713340

C=C/C=c1\c(=C/C=C)n(C)c2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.47
▸ KDM4E B2RXH2 6/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TSHR P16473 2/20 0.39
▸ ALKBH5 Q6P6C2 1/20 0.37
▸ FTO Q9C0B1 1/20 0.37
▸ CYP2C19 P33261 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ NQO2 P16083 1/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ LMNA P02545 2/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ ERCC1 P07992 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ ERCC4 Q92889 1/20 0.35
▸ HSD17B10 Q99714 3/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ MAPK1 P28482 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
SCHEMBL23874998 0.91 GPR3 (0.45) GPR3KDM4EMAPTTSHRALKBH5
SCHEMBL18626366 0.90 GPR3 (0.44) GPR3KDM4EMAPTTSHRALKBH5
SCHEMBL23625525 0.82 GPR3 (0.47) GPR3KDM4EMAPTTSHRALKBH5
SCHEMBL22352479 0.78 GPR3 (0.31) GPR3
SCHEMBL20857465 0.78 GPR3 (0.31) GPR3
SCHEMBL14233356 0.76 L3MBTL1 (0.50) KDM4EMAPTCYP2C19CYP1A2ALDH1A1
SCHEMBL18746036 0.76 GPR3 (0.52) GPR3KDM4EMAPTALKBH5FTO
SCHEMBL21578607 0.75 GPR3 (0.31) GPR3
SCHEMBL19774619 0.75 GPR3 (0.31) GPR3
SCHEMBL16870944 0.75 GPR3 (0.31) GPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4289855-A1 METHOD FOR PREPARING PHOSPHORUS-CONTAINING LIGAND Zhejiang NHU Company Ltd. (CN) 2023-12-13 — — EP disclosed
US-20230303537-A1 NITROGEN-CONTAINING COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE THEREOF SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-28 — — US disclosed
US-20230209992-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-06-29 — — US disclosed
US-20230203239-A1 Cyclic ether-anhydride photopolyaddition and uses thereof UNIVERSITÉ DE HAUTE-ALSACE (FR) 2023-06-29 — — US disclosed
US-20220109115-A1 POLYCYCLIC COMPOUND, AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE POLYCYCLIC COMPOUND IDEMITSU KOSAN CO.,LTD. (JP) 2022-04-07 — — US disclosed
US-20210363286-A1 Ultrafast Cyclic Ether-Amine Photopolyaddition And Uses Thereof UNIVERSITÉ DE HAUTE-ALSACE (FR) 2021-11-25 — — US disclosed
EP-3909946-A2 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE Samsung Display Co., Ltd. (KR) 2021-11-17 — — EP disclosed
US-9624171-B2 Photoinitiator mixtures BASF SE (DE) 2017-04-18 — — US disclosed
US-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES IDEMITSU KOSAN CO., LTD. (JP) 2017-04-06 — — 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 (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-20220109115-A1 POLYCYCLIC COMPOUND, AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE POLYCYCLIC COMPOUND ODC1, OTC, PKD1 GPR3 3959/4885KDM4E 2871/4885MAPT 3163/4885
US-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES DBF4, DDT, SLC43A3 GPR3 4658/4885KDM4E 2610/4885MAPT 2086/4885
US-20230303537-A1 NITROGEN-CONTAINING COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE THEREOF NPM1, NFE2L2, MNS1 GPR3 4534/4885KDM4E 2222/4885MAPT 2129/4885

“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.

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