SCHEMBL3554094

SCHEMBL3554094

CC(=O)n1cc(O)c2ccc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
KDM4E B2RXH2 2/20 0.41
NPC1 O15118 2/20 0.41
MAPT P10636 2/20 0.41
RAB9A P51151 2/20 0.41
S1PR4 O95977 1/20 0.41
S1PR1 P21453 1/20 0.41
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 1/20 0.39
NOTUM Q6P988 4/20 0.38
KMO O15229 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
KCNH2 Q12809 1/20 0.37
ABCB11 O95342 1/20 0.36
MAT2A P31153 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
CLK1 P49759 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
SCHEMBL2475378 0.87 NOTUM (0.45) KMT2AMEN1KDM4ENPC1MAPT
SCHEMBL27636554 0.83 KMO (0.38) NPSR1GAAKMOKCNH2
SCHEMBL28683409 0.81 ALDH1A1 (0.41) KMT2AMEN1KDM4ENPC1MAPT
SCHEMBL28696581 0.80 IDO1 (0.37) KMT2AMEN1KDM4EATMNOTUM
SCHEMBL3241798 0.78 ABCB11 (0.46) KMT2AMEN1KDM4ENPC1MAPT
SCHEMBL28693273 0.78 MTNR1A (0.49) KDM4ENPC1MAPTRAB9ANOTUM
SCHEMBL28977346 0.77 AKR1C3 (0.49) KMO
SCHEMBL28706030 0.76 BRD4 (0.45) KDM4EMAPT
SCHEMBL1333179 0.75 HTT (0.54) KMT2AMEN1KDM4ENPC1MAPT
SCHEMBL9300394 0.75 MEN1 (0.39) KMT2AMEN1KDM4ENPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057625-B C2-acyloxy-3-indolinone derivative and preparation method and application thereof 五邑大学 2023-11-24 CN disclosed
CN-114057625-A C2-acyloxy-3-indolinone derivative and preparation method and application thereof 五邑大学 2022-02-18 CN disclosed
EP-1567492-B1 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LTD (IN) 2013-05-22 EP disclosed
US-7718690-B2 N-arylsulfonyl-3-aminoalkoxyindoles RAMAKRISHNA VENKATA SATYA NIROGI 2010-05-18 US disclosed
US-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LIMITED (IN) 2009-05-21 US disclosed
EP-1567492-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES Suven Life Sciences Limited (IN) 2005-08-31 EP disclosed
WO-2004048328-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed
WO-2004048331-A1 N-ARYLALKYL-3-AMINOALKOXYINDOLES AND THEIR USE AS 5-HT LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed
US-6699685-B1 (4),6,(7)-(DI,TRI)CHLOROINDOLYL-BETA-D-GALACTOSIDE INDICATORS; PRODUCE MAUVE OR MAGENTA PRECIPITATES WHEN REACTED UPON BY BETA-GALACTOSIDASE; CONTRASTS IN COLOR WITH GLUCURONIDASE SUBSTRATES RCR SCIENTIFIC, INC. 2004-03-02 US disclosed
US-5393662-A Nutrient base medium containing chromogenic indolyl beta-galactosidase substrate forming insoluble colored compound upon reacting with beta-galactosidase RCR SCIENTIFIC, INC. (US) 1995-02-28 US disclosed
US-5364767-A 6-chloroindole derivatives; colorimetric and quantitative analysis RESEARCH ORGANICS, IN. (US) 1994-11-15 US disclosed
US-5358854-A 6-chloroindolyl-beta-D-galactosie; 6-chloroindolyl-beta-D-gulcoronide 6-chloriindolyl-beta-D-gulcuronic acid monocyclohexylammonium salt RESEARCH ORGANICS, INC. (US) 1994-10-25 US disclosed
US-5210022-A Substrates sensitive to beta-galactosidase and beta-glucuronidase, quantitative analysis RCR SCIENTIFIC, INC. (US) 1993-05-11 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-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles HTR3C, HTR3A, AANAT KMT2A 1753/4885MEN1 1490/4885KDM4E 3751/4885

“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.