Fadolmidine

Fadolmidine

SCHEMBL2641380

Oc1ccc2c(c1)C(Cc1c[nH]cn1)CC2

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2C

The experimentally established mechanism targets of Fadolmidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.59
ESR2 Q92731 5/20 0.59
NQO2 P16083 1/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
CYP19A1 P11511 2/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
DRD2 P14416 3/20 0.39
DRD3 P35462 3/20 0.39
LMNA P02545 1/20 0.38

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
Fadolmidine SCHEMBL29365481 1.00 ESR1 (0.59) ESR1ESR2NQO2MTNR1AMTNR1B
Fadolmidine SCHEMBL29489898 0.99 ESR1 (0.58) ESR1ESR2NQO2MTNR1AMTNR1B
Fadolmidine SCHEMBL2641142 0.99 ESR1 (0.58) ESR1ESR2NQO2MTNR1AMTNR1B
SCHEMBL7111508 0.94 ESR1 (0.52) ESR1ESR2NQO2MTNR1AMTNR1B
Hydrochloric Acid SCHEMBL7038089 0.92 ESR1 (0.51) ESR1ESR2NQO2MTNR1AMTNR1B
SCHEMBL1339421 0.89 ESR1 (0.59) ESR1ESR2CYP19A1
SCHEMBL7034308 0.84 ESR1 (0.40) ESR1ESR2SLC6A4
SCHEMBL7153910 0.83 ADRA2A (0.53) ESR1ESR2DRD2
SCHEMBL7039816 0.83 ESR1 (0.60) ESR1ESR2CYP19A1
SCHEMBL27370373 0.81 ESR1 (0.41) ESR1ESR2CYP19A1

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 51 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9446025-B2 Treatment or prevention of hypotension and shock RECRO PHARMA, INC. (US) 2016-09-20 US claimed
US-20160030392-A1 Treatment Or Prevention Of Hypotension And Shock SOCIETAL CDMO, INC. 2016-02-04 US claimed
US-9078883-B2 Treatment or prevention of hypotension and shock RECRO PHARMA, INC. (US) 2015-07-14 US claimed
US-20140100257-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK RECRO PHARMA, INC. (US) 2014-04-10 US claimed
US-8470862-B2 Treatment or prevention of hypotension and shock RECRO PHARMA, INC. (US) 2013-06-25 US claimed
US-20110294862-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK ORION CORPORATION 2011-12-01 US claimed
JP-4741131-B2 2011-08-03 JP claimed
US-20070185181-A1 Treatment or prevention of hypotension and shock ORION CORPORATION 2007-08-09 US claimed
EP-1223931-B1 USE OF A IMIDAZOLE DERIVATIVE FOR THE TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK ORION CORP (FI) 2005-12-14 EP claimed
EP-1117399-B1 USE OF 3-(1H-IMIDAZOL-4-YLMETHYL)-INDAN-5-OL IN THE MANUFACTURE OF A MEDICAMENT FOR INTRASPINAL, INTRATHECAL OR EPIDURAL ADMINISTRATION ORION CORP (FI) 2005-02-09 EP claimed
US-6495584-B1 ANALGESIA TREATMENT ORION CORPORATION (FI) 2002-12-17 US claimed
JP-2002525324-A 2002-08-13 JP claimed
EP-1223931-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK ORION CORPORATION (FI) 2002-07-24 EP claimed
US-6313311-B1 ADRENERGIC STIMULANTS FOR POTENTIATING ANESTHETICS PRIOR TO SURGERY; HYPOTENSIVE AGENTS, ANALGESICS, ANTIISCHEMIC AGENTS; NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS ORION CORPORATION (FI) 2001-11-06 US claimed
EP-1117399-A1 USE OF 3-(1H-IMIDAZOL-4-YLMETHYL)-INDAN-5-OL IN THE MANUFACTURE OF A MEDICAMENT FOR INTRASPINAL, INTRATHECAL OR EPIDURAL ADMINISTRATION ORION CORPORATION (FI) 2001-07-25 EP claimed
WO-2001030347-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK ORION CORPORATION (FI) 2001-05-03 WO claimed
WO-2000018400-A1 USE OF 3-(1H-IMIDAZOL-4-YLMETHYL)-INDAN-5-OL IN THE MANUFACTURE OF A MEDICAMENT FOR INTRASPINAL, INTRATHECAL OR EPIDURAL ADMINISTRATION ORION CORPORATION (FI) 2000-04-06 WO claimed
US-9446025-B2 Treatment or prevention of hypotension and shock RECRO PHARMA, INC. (US) 2016-09-20 US disclosed
US-5677115-A DESILVERIZATION; THIOETHER FIXING COMPOUND; DECOLORATION INHIBITION FUJI PHOTO FILM CO., LTD. (JP) 1997-10-14 US disclosed
WO-1997012874-A1 IMIDAZOLE DERIVATIVES HAVING AFFINITY FOR ALPHA2 RECEPTORS ACTIVITY Orion-Yhtymä Oy (FI) 1997-04-10 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-20160030392-A1 Treatment Or Prevention Of Hypotension And Shock TNNI3, ADRB3, TNNC1 ESR1 4863/4885ESR2 4839/4885NQO2 1974/4885
US-20070185181-A1 Treatment or prevention of hypotension and shock TNNI3, TNNC1, ADRB3 ESR1 4870/4885ESR2 4835/4885NQO2 3045/4885
US-20110294862-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK TNNI3, TNNC1, ADRB3 ESR1 4870/4885ESR2 4835/4885NQO2 3045/4885
US-20140100257-A1 TREATMENT OR PREVENTION OF HYPOTENSION AND SHOCK TNNI3, ADRB3, TNNC1 ESR1 4863/4885ESR2 4839/4885NQO2 1974/4885

“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.