SCHEMBL7756746

SCHEMBL7756746

Cc1cccc2c1C(=O)C(=O)N2C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.52
CES1 P23141 1/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.52
CASP3 P42574 2/20 0.39
BRD4 O60885 2/20 0.39
DPP4 P27487 1/20 0.39
MGLL Q99685 1/20 0.38
AADAT Q8N5Z0 1/20 0.37
NTRK1 P04629 1/20 0.36
LMNA P02545 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL14880102 0.93 MEN1 (0.46) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL28074688 0.82 TTR (0.50) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL1137933 0.78 TTR (0.55) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL21848273 0.78 TTR (0.50) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL754994 0.78 CES1 (0.50) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL2290914 0.78 TTR (0.50) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL15206754 0.78 TTR (0.50) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL5803629 0.78 AADAT (0.46) MEN1KMT2AALDH1A1POLBDPP4
SCHEMBL28074698 0.77 TTR (0.48) TTRCES1MEN1KMT2AALDH1A1
SCHEMBL25327968 0.76 TDP2 (0.47) TTRCES1MEN1KMT2AALDH1A1

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-113564623-A Method for preparing isatin compound by electrochemically oxidizing N-substituted indole derivative 福建师范大学 2021-10-29 CN disclosed
CN-106749295-B A kind of synthetic method of loop coil Oxoindole gamma-butyrolacton class compound 中国药科大学 2019-04-12 CN disclosed
CN-109438324-A One kind is containing α derived from trifluoro methyl indole, the chiral method for preparing of beta-amino acids analog 广西中医药大学 2019-03-08 CN disclosed
US-9828342-B2 Isatin derivatives, pharmaceutical compositions thereof, and methods of use thereof CITY OF HOPE (US) 2017-11-28 US disclosed
US-9828342-B2 Isatin derivatives, pharmaceutical compositions thereof, and methods of use thereof CITY OF HOPE (US) 2017-11-28 US disclosed
CN-102292397-B Organic black pigments and their preparation BASF SE 2014-12-10 CN disclosed
US-20130225637-A1 ISATIN DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-08-29 US disclosed
US-20130225637-A1 ISATIN DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2013-08-29 US disclosed
US-8450343-B2 Gamma secretase modulators SCHERING CORPORATION 2013-05-28 US disclosed
CN-101786980-B Synthesis method of isatin derivatives BINGHAI KANGJIE CHEMICALS CO LTD 2012-12-05 CN disclosed
US-7998954-B2 Pyrimidodiazepinone derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-08-16 US disclosed
US-7998954-B2 Pyrimidodiazepinone derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-08-16 US disclosed
US-20100190775-A1 PYRIMIDODIAZEPINONE DERIVATIVE KYOWA HAKKO KIRIN CO., LTD (JP) 2010-07-29 US disclosed
US-20100190775-A1 PYRIMIDODIAZEPINONE DERIVATIVE KYOWA HAKKO KIRIN CO., LTD (JP) 2010-07-29 US disclosed
EP-1073407-A1 HAIR DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE ORQUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISO-INDOLONE DERIVATIVES L'OREAL (FR) 2001-02-07 EP disclosed
EP-1056435-A1 DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE OR QUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVES L'OREAL (FR) 2000-12-06 EP disclosed
WO-2000038640-A1 HAIR DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE OR QUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISO-INDOLONE DERIVATIVES L'OREAL (FR) 2000-07-06 WO disclosed
WO-2000038641-A1 DYEING METHOD USING AN ALIPHATIC CATIONIC AMINE AND A ALDEHYDE OR KETONE OR QUINONE OR DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVES L'OREAL (FR) 2000-07-06 WO disclosed
CN-1202933-A Improved microbial production of indigo GENENCOR INT (US) 1998-12-23 CN disclosed
CN-85103527-A Preparation N, the method for the disubstituted 2-hydroxyindole of 3--1-hydroxyalkyl cooh amide 1987-01-28 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 (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-20130225637-A1 ISATIN DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE THEREOF JAK2, ERBB2, CDC25C TTR 4346/4885CES1 4251/4885MEN1 1485/4885
US-20100190775-A1 PYRIMIDODIAZEPINONE DERIVATIVE KCNJ1, KCNJ11, ADRA1D TTR 4346/4885CES1 1348/4885MEN1 765/4885

“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.