SCHEMBL8649226

SCHEMBL8649226

Cc1ccccc1C(C)NC(C)c1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.50
ADRB2 P07550 1/20 0.44
ACHE P22303 2/20 0.43
TSHR P16473 1/20 0.43
SOS1 Q07889 1/20 0.39
ACP3 P15309 1/20 0.38
ALDH1A1 P00352 2/20 0.37
SLC6A4 P31645 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
GAA P10253 1/20 0.36
ADRA2A P08913 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
GPR139 Q6DWJ6 1/20 0.35
HDAC1 Q13547 1/20 0.35
HTR2A P28223 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
SCHEMBL15247632 0.83 ESR1 (0.48) ESR1ADRB2ACHETSHRSOS1
SCHEMBL2402249 0.83 SLC6A4 (0.50) ESR1ADRB2ACHETSHRSOS1
SCHEMBL6114378 0.81 ESR1 (0.46) ESR1ADRB2ACHETSHRSOS1
SCHEMBL28879943 0.81 ESR1 (0.46) ESR1ADRB2ACHETSHRSOS1
SCHEMBL24105695 0.78 ESR1 (0.48) ESR1ADRB2ACHETSHRSOS1
SCHEMBL20365617 0.78 ADRB2 (0.50) ESR1ADRB2ACHETSHRSOS1
SCHEMBL16308854 0.78 TDP1 (0.52) ESR1ADRB2TSHRSOS1ACP3
SCHEMBL2332685 0.77 ESR1 (0.52) ESR1ACHETSHRACP3ALDH1A1
SCHEMBL143737 0.77 ESR1 (0.52) ESR1ACHETSHRACP3ALDH1A1
SCHEMBL3867592 0.77 ESR1 (0.52) ESR1ACHETSHRACP3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2663335-A1 A COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES Medestea Internazionale S.p.A. (IT) 2013-11-20 EP claimed
US-20130287757-A1 COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES MEDESTEA INTERNAZIONALE S.P.A. (IT) 2013-10-31 US claimed
WO-2012095702-A1 A COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES MEDESTEA INTERNAZIONALE S.P.A. (IT) 2012-07-19 WO claimed
EP-2663335-A1 A COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES Medestea Internazionale S.p.A. (IT) 2013-11-20 EP disclosed
US-20130287757-A1 COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES MEDESTEA INTERNAZIONALE S.P.A. (IT) 2013-10-31 US disclosed
WO-2012095702-A1 A COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES MEDESTEA INTERNAZIONALE S.P.A. (IT) 2012-07-19 WO disclosed
EP-0862550-A1 CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1998-09-09 EP disclosed
WO-1997009294-A1 CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1997-03-13 WO disclosed
EP-0263280-B1 PROCESS FOR THE PREPARATION OF ELASTIC AND FLEXIBLE OPEN-CELL POLYURETHANE FOAMS HAVING AN ENHANCED STRAIN HARDNESS BAYER AG (DE) 1991-07-24 EP disclosed
EP-0369286-A2 Dibenzozepine derivatives for treating acute and chronic obstructive diseases of the respiratory tract Dr. Karl Thomae GmbH (DE) 1990-05-23 EP disclosed
EP-0263280-A1 Process for the preparation of elastic and flexible open-cell polyurethane foams having an enhanced strain hardness BAYER AG (DE) 1988-04-13 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 (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-20130287757-A1 COMPOSITION FOR THE REGENERATION OF ATROPHIC TISSUES CUTA, UNG, MMP1 ESR1 4153/4885ADRB2 814/4885ACHE 27/4885

“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.