SCHEMBL9181528

SCHEMBL9181528

NC(=O)Cc1cccc2cccnc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.57
HDAC6 Q9UBN7 2/20 0.49
ALDH1A1 P00352 5/20 0.48
LMNA P02545 2/20 0.48
MMP2 P08253 2/20 0.47
TSHR P16473 2/20 0.47
CHRM1 P11229 1/20 0.47
COMT P21964 1/20 0.47
ADRA1A P35348 1/20 0.47
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 5/20 0.46
HPGD P15428 3/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
CYP3A4 P08684 2/20 0.45
GMNN O75496 1/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL12899533 0.86 PARP1 (0.51) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL3711541 0.84 KDM4E (0.59) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL19036261 0.84 HDAC6 (0.50) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL30553881 0.84 KDM4E (0.59) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL9268906 0.83 HDAC6 (0.49) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL6189901 0.83 PARP1 (0.49) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL1285339 0.82 PARP1 (0.53) PARP1HDAC6ALDH1A1LMNAMMP2
SCHEMBL29456254 0.79 MAPK8 (0.45) PARP1HDAC6ALDH1A1LMNAADRA1A
SCHEMBL6902980 0.79 MAPK8 (0.45) PARP1HDAC6ALDH1A1LMNAADRA1A
SCHEMBL24822355 0.79 HDAC6 (0.49) PARP1HDAC6ALDH1A1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110423217-B Preparation method of conjugated eneyne compound 大连理工大学 2022-04-12 CN claimed
CN-110423217-A A kind of preparation method of conjugated enynes compound UNIV DALIAN TECH 2019-11-08 CN claimed
CN-107522658-B Sour cyanines probe in a kind of symmetrical side in 1,3 based on amide groups quinoline and its preparation method and application 常州大学 2019-06-04 CN claimed
CN-107522658-A A kind of 1,3 symmetrical sour cyanines probes in side based on amide groups quinoline and its preparation method and application 常州大学 2017-12-29 CN claimed
CN-104592983-B Fluorescent probes based on pyrene, and preparation method and application thereof 渤海大学 2017-03-22 CN claimed
CN-105038769-A Fluorescent probe based on 8-aminoquinoline derivative and synthetic method and application thereof UNIV BOHAI 2015-11-11 CN claimed
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed
US-20220081427-A1 INHIBITORS OF JUN N-TERMINAL KINASE IMAGO PHARMACEUTICALS, INC. (US) 2022-03-17 US disclosed
CN-110423217-A A kind of preparation method of conjugated enynes compound UNIV DALIAN TECH 2019-11-08 CN disclosed
CN-107522658-B Sour cyanines probe in a kind of symmetrical side in 1,3 based on amide groups quinoline and its preparation method and application 常州大学 2019-06-04 CN disclosed
CN-108250141-A Methyl-P-tyrosine modifies N-(8- quinolyls)Acetamide compound, synthetic method and application 华南师范大学 2018-07-06 CN disclosed
CN-108250141-A Methyl-P-tyrosine modifies N-(8- quinolyls)Acetamide compound, synthetic method and application 华南师范大学 2018-07-06 CN disclosed
CN-105038769-A Fluorescent probe based on 8-aminoquinoline derivative and synthetic method and application thereof UNIV BOHAI 2015-11-11 CN disclosed
CN-100412062-C Synthesis of enantiomerically pure amino-substituted fused bicyclic rings ANORMED INC (CA) 2008-08-20 CN disclosed
CN-1608052-A Synthesis of enantiomerically pure amino-substituted fused bicyclic rings ANORMED INC (CA) 2005-04-20 CN disclosed
US-5405843-A Anticancer drug potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-04-11 US disclosed
EP-0363212-B1 Novel heterocyclic compounds and anticancer-drug reinforcing agents containing them as effective components MITSUI TOATSU CHEMICALS (JP) 1995-01-04 EP disclosed
US-5204348-A Quinoline derivatives MITSUI TOATSU CHEMICALS INC. (JP) 1993-04-20 US disclosed
US-5112817-A Anticancer Drug Potentiators MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1992-05-12 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 (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-20220081427-A1 INHIBITORS OF JUN N-TERMINAL KINASE CHUK, MAPK6, MAPK3 PARP1 1492/4885HDAC6 420/4885ALDH1A1 4529/4885

“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.