SCHEMBL9052803

SCHEMBL9052803

CCOC(=O)c1ccn2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
KDM4E B2RXH2 12/20 0.57
ALDH1A1 P00352 11/20 0.57
HPGD P15428 6/20 0.57
GAA P10253 5/20 0.57
GLA P06280 1/20 0.57
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
NPSR1 Q6W5P4 2/20 0.53
RXFP1 Q9HBX9 1/20 0.53
MAPT P10636 4/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ATM Q13315 1/20 0.52
HSD17B10 Q99714 1/20 0.50

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
Oxalic Acid SCHEMBL27545073 0.95 ALDH1A1 (0.54) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL28161534 0.83 TSHR (0.61) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL17331852 0.83 KDM4E (0.60) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL3983002 0.81 NR4A2 (0.50) TSHRKDM4EALDH1A1GAAMEN1
SCHEMBL27930822 0.81 ALDH1A1 (0.55) TSHRALDH1A1HPGDKMT2ACYP1A2
SCHEMBL8123256 0.81 CREBBP (0.45) KDM4EALDH1A1HPGDGAAGLA
SCHEMBL17331579 0.79 KDM4E (0.56) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL17331543 0.79 KDM4E (0.56) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL26413736 0.78 TSHR (0.48) TSHRKDM4EALDH1A1HPGDGAA
SCHEMBL20226860 0.78 KMT2A (0.45) TSHRKDM4EALDH1A1HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102977097-A Aryne-based substituted indolizine derivative and preparation method and applications thereof UNIV SHAOXING 2013-03-20 CN claimed
CN-102977126-A Dual-indolizine substitutive derivative as well as preparation method and use thereof UNIV SHAOXING 2013-03-20 CN claimed
US-20250042900-A1 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2025-02-06 US disclosed
EP-4499058-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION Tactogen Inc. (US) 2025-02-05 EP disclosed
WO-2023183613-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2023-09-28 WO disclosed
WO-2023183613-A2 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TACTOGEN INC (US) 2023-09-28 WO disclosed
EP-2800745-B1 PYRROLO CARBOXAMIDES AS MODULATORS OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORY, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES PHENEX PHARMACEUTICALS AG (DE) 2020-02-12 EP disclosed
US-9815851-B2 Pyrrolo carboxamides as modulators of orphan nuclear receptor RAR-related orphan receptor-gamma (RORγ, NR1F3) activity and for the treatment of chronic inflammatory and autoimmune diseases PHENEX PHARMACEUTICALS AG (DE) 2017-11-14 US disclosed
CN-102977097-B A kind of sweet-smelling alkynyl substituted indole oxazine derivative and its production and use SHAOXING UNIVERSITY (CN) 2015-10-14 CN disclosed
US-20140349987-A1 PYRROLO CARBOXAMIDES AS MODULATORS OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORy, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES PHENEX PHARMACEUTICALS AG (DE) 2014-11-27 US disclosed
EP-2800745-A1 PYRROLO CARBOXAMIDES AS MODULATORS OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORY, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES Phenex Pharmaceuticals AG (DE) 2014-11-12 EP disclosed
CN-102977126-B Dual-indolizine substitutive derivative as well as preparation method and use thereof UNIV SHAOXING 2014-07-02 CN disclosed
WO-2013079223-A1 PYRROLO CARBOXAMIDES AS MODULATORS OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORϒ, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES PHENEX PHARMACEUTICALS AG (DE) 2013-06-06 WO disclosed
CN-102977097-A Aryne-based substituted indolizine derivative and preparation method and applications thereof UNIV SHAOXING 2013-03-20 CN disclosed
CN-102977126-A Dual-indolizine substitutive derivative as well as preparation method and use thereof UNIV SHAOXING 2013-03-20 CN disclosed
EP-0471609-B1 Benzofuran Derivatives, Benzothiophenes, Indoles or Indolizines, Process for Production and Compositions containing them SANOFI SA (FR) 1996-11-27 EP disclosed
EP-0471609-A1 Benzofuran Derivatives, Benzothiophenes, Indoles or Indolizines, Process for Production and Compositions containing them SANOFI (FR) 1992-02-19 EP 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-20140349987-A1 PYRROLO CARBOXAMIDES AS MODULATORS OF ORPHAN NUCLEAR RECEPTOR RAR-RELATED ORPHAN RECEPTOR-GAMMA (RORy, NR1F3) ACTIVITY AND FOR THE TREATMENT OF CHRONIC INFLAMMATORY AND AUTOIMMUNE DISEASES RORA, RORB, RORC TSHR 152/4885KDM4E 2519/4885ALDH1A1 2097/4885
US-20250042900-A1 INDOLIZINE COMPOUNDS FOR THE TREATMENT OF MENTAL DISORDERS OR INFLAMMATION TPH2, TPH1, IDO2 TSHR 1451/4885KDM4E 3156/4885ALDH1A1 2187/4885

“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.