SCHEMBL4580049

SCHEMBL4580049

c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1conn1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ MEN1 O00255 1/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ TSHR P16473 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ KCNA3 P22001 1/20 0.30

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
Fluoride SCHEMBL28204728 0.96 ALDH1A1 (0.38) ALDH1A1TDP1L3MBTL1KDM4ECYP1A2
Anthracene SCHEMBL27904482 0.91 ALDH1A1 (0.34) ALDH1A1TDP1L3MBTL1KDM4ECYP1A2
Pyrrole SCHEMBL28204826 0.89 ALDH1A1 (0.33) ALDH1A1TDP1L3MBTL1KDM4ECYP1A2
Biphenyl SCHEMBL2533455 0.80 NOTUM (0.44) ALDH1A1TDP1CYP1A2CYP3A4MAPT
Biphenyl SCHEMBL5477829 0.80 NOTUM (0.44) ALDH1A1TDP1CYP1A2CYP3A4MAPT
Benzene SCHEMBL27338794 0.79 PARP1 (0.33) —
Biphenyl SCHEMBL28077267 0.78 NOTUM (0.42) ALDH1A1TDP1CYP1A2CYP3A4MAPT
Naphthalene SCHEMBL27805984 0.78 CYP2A6 (0.40) ALDH1A1
Iodobenzene SCHEMBL27533418 0.77 HDAC8 (0.33) —
Fluorobenzene SCHEMBL28654904 0.77 NFE2L2 (0.32) —

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112795070-A Prefabricated direct-buried heat-insulation pipe and manufacturing method thereof 河南亿阳管业科技有限公司 2021-05-14 — — CN claimed
CN-104560028-A Carbazolyl triphenylamine-oxadiazole fluorescent molecule as well as preparation method and application thereof UNIV SOUTHEAST 2015-04-29 — — CN claimed
CN-103087000-A Oxadiazole-triphenylamine-anthracene conjugated molecule with three-photon fluorescence characteristic UNIV SOUTHEAST 2013-05-08 — — CN claimed
CN-100426556-C Single layer organic electro luminuous device UNIV TSINGHUA (CN) 2008-10-15 — — CN claimed
CN-1514678-A Single layer organic electro luminuous device 清华大学 2004-07-21 — — CN claimed
CN-110582550-B Dendrimers comprising luminescent platinum (II) compounds for organic light-emitting devices and preparation thereof 香港大学 2023-11-28 — — CN disclosed
CN-112795070-A Prefabricated direct-buried heat-insulation pipe and manufacturing method thereof 河南亿阳管业科技有限公司 2021-05-14 — — CN disclosed
CN-112795070-A Prefabricated direct-buried heat-insulation pipe and manufacturing method thereof 河南亿阳管业科技有限公司 2021-05-14 — — CN disclosed
US-20200052229-A1 DENDRIMERS CONTAINING LUMINESCENT PLATINUM(II) COMPOUNDS FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THE UNIVERSITY OF HONG KONG (CN) 2020-02-13 — — US disclosed
CN-110582550-A Dendrimer comprising a luminescent platinum (II) compound for organic light emitting device and preparation thereof 香港大学 2019-12-17 — — CN disclosed
WO-2018192436-A1 DENDRIMERS CONTAINING LUMINESCENT PLATINUM(II) COMPOUNDS FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THE UNIVERSITY OF HONG KONG (CN) 2018-10-25 — — WO disclosed
CN-106496260-B Pyrroles feux rouges compound OPA BODIPY of Yi Zhong oxadiazole triphenylamine fluorine boron two and its preparation method and application 东南大学 2018-03-23 — — CN disclosed
CN-103087000-A Oxadiazole-triphenylamine-anthracene conjugated molecule with three-photon fluorescence characteristic UNIV SOUTHEAST 2013-05-08 — — CN disclosed
CN-102341476-A Ambipolar host in organic light emitting diode NITTO DENKO CORP 2012-02-01 — — CN disclosed
CN-100426556-C Single layer organic electro luminuous device UNIV TSINGHUA (CN) 2008-10-15 — — CN disclosed
US-7402343-B2 Molecular chemical compounds with structures allowing electron displacement and capable of emitting photoluminescent radiation, and photoluminescence quenching device employing the same SAMSUNG SDI CO., LTD. (KR) 2008-07-22 — — US disclosed
CN-101081978-A Multi-branched oxdiazole two-photon pump fluorescent material and preparation method thereof UNIV SOUTHEAST (CN) 2007-12-05 — — CN disclosed
CN-1519235-A Compound of permitting electtronic migration and emitting photoluminescence radiation structure and its application ����SDI��ʽ���� 2004-08-11 — — CN disclosed
US-20040147701-A1 Molecular chemical compounds with structures allowing electron displacement and capable of emitting photoluminescent radiation, and photoluminescence quenching device employing the same SAMSUNG DISPLAY CO., LTD. (KR) 2004-07-29 — — US disclosed
CN-1514678-A Single layer organic electro luminuous device 清华大学 2004-07-21 — — CN 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-20200052229-A1 DENDRIMERS CONTAINING LUMINESCENT PLATINUM(II) COMPOUNDS FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION PDCD1LG2, PDCD2L, LIG3 ALDH1A1 1523/4885TDP1 2527/4885L3MBTL1 954/4885

“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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