SCHEMBL3560128

SCHEMBL3560128

COc1ccc2c(c1)c(O)cn2C(C)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.59
AKR1C3 P42330 6/20 0.48
AKR1C2 P52895 2/20 0.48
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MTNR1B P49286 3/20 0.44
NQO2 P16083 1/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
AKR1C4 P17516 1/20 0.43
PTGS1 P23219 1/20 0.43
EP300 Q09472 2/20 0.43
CREBBP Q92793 2/20 0.43
HTT P42858 1/20 0.43
BAZ2B Q9UIF8 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL28693273 0.88 MTNR1A (0.49) MTNR1AAKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL27998896 0.83 MTNR1A (0.57) MTNR1AAKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL13121580 0.81 BAZ2B (0.56) MTNR1AALDH1A1MAPTRAB9ANPC1
SCHEMBL13172044 0.81 MTNR1A (0.55) MTNR1AAKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL2887696 0.81 MTNR1A (0.55) MTNR1AAKR1C3AKR1C2ALDH1A1
SCHEMBL30394848 0.81 MTNR1A (0.55) MTNR1AAKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL28684424 0.79 RAB9A (0.42) MTNR1AALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL22919631 0.78 MAOB (0.56) RAB9ANPC1BAZ2B
SCHEMBL3567471 0.78 ALDH1A1 (0.41) MTNR1AAKR1C3AKR1C2ALDH1A1HPGD
SCHEMBL1271943 0.78 PDGFRA (0.41) MTNR1AHPGDMAPTSMN1; SMN2CREBBP

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 21 patents — showing the first 20. 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
EP-1751156-B1 6,7,8,9-SUBSTITUTED 1-PHENYL-1,5-DIHYDRO-PYRIDO(3,2-B)INDOL-2-ONES USEFUL AS ANTI-INFECTIVE PHARMACEUTICAL AGENTS TIBOTEC PHARM LTD (IE) 2010-09-15 EP disclosed
US-7718690-B2 N-arylsulfonyl-3-aminoalkoxyindoles RAMAKRISHNA VENKATA SATYA NIROGI 2010-05-18 US disclosed
US-20100029635-A1 6,7,8,9-SUBSTITUTED 1-PHENYL-1,5-DIHYDRO-PYRIDO[3,2-B]INDOL-2-ONES USEFUL AS ANTI-INFECTIVE PHARMACEUTICAL AGENTS KESTELEYN BART RUDOLF ROMANIE 2010-02-04 US disclosed
US-20100029635-A1 6,7,8,9-SUBSTITUTED 1-PHENYL-1,5-DIHYDRO-PYRIDO[3,2-B]INDOL-2-ONES USEFUL AS ANTI-INFECTIVE PHARMACEUTICAL AGENTS KESTELEYN BART RUDOLF ROMANIE 2010-02-04 US disclosed
US-7622581-B2 6,7,8,9-substituted 1-phenyl-1,5-dihydro-pyrido[3,2-b]indol-2-ones useful as anti-infective pharmaceutical agents TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-11-24 US disclosed
US-7622581-B2 6,7,8,9-substituted 1-phenyl-1,5-dihydro-pyrido[3,2-b]indol-2-ones useful as anti-infective pharmaceutical agents TIBOTEC PHARMACEUTICALS LTD. (IE) 2009-11-24 US disclosed
US-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LIMITED (IN) 2009-05-21 US disclosed
US-7531568-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-05-12 US disclosed
US-7531568-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-05-12 US disclosed
EP-1819673-A2 INDOLE DERIVATIVES FOR USE AS PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-08-22 EP disclosed
US-20070167434-A1 6,7,8,9-Substituted 1-phenyl-1,5-dihydro-pyrido[3,2-b]indol-2-ones useful as anti-infective pharmaceutical agents TIBOTEC BVBA (BE) 2007-07-19 US disclosed
US-20070167434-A1 6,7,8,9-Substituted 1-phenyl-1,5-dihydro-pyrido[3,2-b]indol-2-ones useful as anti-infective pharmaceutical agents TIBOTEC BVBA (BE) 2007-07-19 US disclosed
WO-2006060456-A2 INDOLE DERIVATIVES FOR USE AS PPAR PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2006-06-08 WO disclosed
US-20060116416-A1 PPAR active compounds PLEXXIKON, INC 2006-06-01 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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 MTNR1A 143/4885AKR1C3 1540/4885AKR1C2 1900/4885
US-20100029635-A1 6,7,8,9-SUBSTITUTED 1-PHENYL-1,5-DIHYDRO-PYRIDO[3,2-B]INDOL-2-ONES USEFUL AS ANTI-INFECTIVE PHARMACEUTICAL AGENTS HRH4, CBR1, HRH2 MTNR1A 70/4885AKR1C3 439/4885AKR1C2 986/4885
US-20070167434-A1 6,7,8,9-Substituted 1-phenyl-1,5-dihydro-pyrido[3,2-b]indol-2-ones useful as anti-infective pharmaceutical agents HRH4, CBR1, HRH2 MTNR1A 62/4885AKR1C3 370/4885AKR1C2 909/4885
US-20060116416-A1 PPAR active compounds PPARG, PPARA, PPARD MTNR1A 191/4885AKR1C3 3078/4885AKR1C2 2253/4885

“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.