SCHEMBL231890

SCHEMBL231890

C=CC(N)C1C(=O)Nc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 6/20 0.44
▸ TDO2 P48775 2/20 0.44
▸ KMT2A Q03164 2/20 0.40
▸ GSK3B P49841 2/20 0.40
▸ BRPF1 P55201 1/20 0.35
▸ CREBBP Q92793 1/20 0.35
▸ MAPT P10636 4/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ GAA P10253 1/20 0.35
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL24740169 0.78 IDO1 (0.48) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL24740261 0.78 IDO1 (0.48) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL7770262 0.75 — —
SCHEMBL23836089 0.74 IDO1 (0.46) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL7310972 0.74 IDO1 (0.46) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL9278082 0.72 ALDH1A1 (0.38) IDO1TDO2MAPTALDH1A1TDP1
SCHEMBL12520453 0.71 IDO1 (0.44) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL6243496 0.70 IDO1 (0.46) IDO1TDO2GSK3BBRPF1CREBBP
SCHEMBL20416267 0.70 IDO1 (0.43) IDO1TDO2KMT2AGSK3BBRPF1
SCHEMBL6682761 0.70 HTR2A (0.39) KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362067-B2 3-aminoalkyl-1,3-dihydro-2H-indol-2-one derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-01-29 — — US disclosed
US-8362067-B2 3-aminoalkyl-1,3-dihydro-2H-indol-2-one derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-01-29 — — US disclosed
US-8362067-B2 3-aminoalkyl-1,3-dihydro-2H-indol-2-one derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-01-29 — — US disclosed
EP-2265582-B1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF. SANOFI SA (FR) 2012-01-04 — — EP disclosed
CN-102015642-A Novel 3-aminoalkyl-1, 3-dihydro-2H-indol-2-one derivatives, preparation method and therapeutic use thereof SANOFI AVENTIS 2011-04-13 — — CN disclosed
US-20110059955-A1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-03-10 — — US disclosed
US-20110059955-A1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-03-10 — — US disclosed
EP-2265582-A1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF. Sanofi-Aventis (FR) 2010-12-29 — — EP disclosed
WO-2009115685-A1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF. SANOFI-AVENTIS (FR) 2009-09-24 — — WO disclosed
US-4663482-A Intermediates for preparing 7-(2-aminoethyl)-1,3-benzthia- or oxa- zol-2(3H)-ones SMITHKLINE BECKMAN CORPORATION (US) 1987-05-05 — — US disclosed
EP-0174811-A2 7-(2-aminoethyl)-1,3-Benzthia- or oxa- zol-2(3H) -ones SMITHKLINE BECKMAN CORPORATION (US) 1986-03-19 — — EP disclosed
US-4554284-A 7-(2-Aminoethyl)-1,3-benzthia- or oxa-zol-2(3H)-ones SMITHKLINE BECKMAN CORPORATION (US) 1985-11-19 — — 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-20110059955-A1 NOVEL 3-AMINOALKYL-1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF AVPR1B, AVPR1A, AVPR2 IDO1 160/4885TDO2 1032/4885KMT2A 3237/4885

“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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